USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 498 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 81 HIS : no HD1:sc= 0.428 K(o=0.43,f=-4!) USER MOD Single : A 85 SER OG : rot -82:sc= -2.82! USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 118:sc= 0.15 USER MOD Single : A 96 SER OG : rot -151:sc= -1.22 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN :FLIP amide:sc= -0.127 F(o=-0.69,f=-0.13) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot 156:sc= -1.86! USER MOD Single : A 121 MET CE :methyl -151:sc= -0.093 (180deg=-0.543) USER MOD Single : A 122 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00713) USER MOD Single : A 123 MET CE :methyl -163:sc= -0.0436 (180deg=-0.12) USER MOD Single : A 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN :FLIP amide:sc= -0.938 F(o=-2.3!,f=-0.94) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 120:sc= -1.46 USER MOD Single : A 134 THR OG1 : rot 180:sc= -0.0785 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 144 GLN : amide:sc= -2.92! C(o=-2.9!,f=-4.3!) USER MOD ----------------------------------------------------------------- ATOM 130 N HIS A 81 -5.391 8.372 2.717 1.00 1.00 N ATOM 131 CA HIS A 81 -5.522 7.101 3.411 1.00 1.00 C ATOM 132 C HIS A 81 -4.146 6.634 3.889 1.00 1.00 C ATOM 133 O HIS A 81 -3.121 7.097 3.392 1.00 1.00 O ATOM 134 CB HIS A 81 -6.226 6.070 2.527 1.00 1.00 C ATOM 135 CG HIS A 81 -6.351 4.704 3.157 1.00 1.00 C ATOM 136 ND1 HIS A 81 -6.701 4.520 4.484 1.00 1.00 N ATOM 137 CD2 HIS A 81 -6.172 3.458 2.631 1.00 1.00 C ATOM 138 CE1 HIS A 81 -6.727 3.219 4.733 1.00 1.00 C ATOM 139 NE2 HIS A 81 -6.398 2.563 3.584 1.00 1.00 N ATOM 0 HA HIS A 81 -6.151 7.226 4.293 1.00 1.00 H new ATOM 0 HB2 HIS A 81 -7.222 6.438 2.281 1.00 1.00 H new ATOM 0 HB3 HIS A 81 -5.679 5.977 1.589 1.00 1.00 H new ATOM 0 HD2 HIS A 81 -5.893 3.237 1.611 1.00 1.00 H new ATOM 0 HE1 HIS A 81 -6.967 2.759 5.680 1.00 1.00 H new ATOM 0 HE2 HIS A 81 -6.336 1.551 3.475 1.00 1.00 H new ATOM 146 N ILE A 82 -4.168 5.720 4.848 1.00 1.00 N ATOM 147 CA ILE A 82 -2.935 5.183 5.399 1.00 1.00 C ATOM 148 C ILE A 82 -3.075 3.670 5.574 1.00 1.00 C ATOM 149 O ILE A 82 -3.961 3.203 6.289 1.00 1.00 O ATOM 150 CB ILE A 82 -2.559 5.919 6.687 1.00 1.00 C ATOM 151 CG1 ILE A 82 -2.545 7.433 6.469 1.00 1.00 C ATOM 152 CG2 ILE A 82 -1.229 5.406 7.242 1.00 1.00 C ATOM 153 CD1 ILE A 82 -1.277 7.869 5.731 1.00 1.00 C ATOM 0 H ILE A 82 -5.020 5.338 5.258 1.00 1.00 H new ATOM 0 HA ILE A 82 -2.106 5.349 4.710 1.00 1.00 H new ATOM 0 HB ILE A 82 -3.322 5.710 7.436 1.00 1.00 H new ATOM 0 HG12 ILE A 82 -3.424 7.730 5.896 1.00 1.00 H new ATOM 0 HG13 ILE A 82 -2.604 7.943 7.430 1.00 1.00 H new ATOM 0 HG21 ILE A 82 -0.984 5.945 8.157 1.00 1.00 H new ATOM 0 HG22 ILE A 82 -1.312 4.341 7.459 1.00 1.00 H new ATOM 0 HG23 ILE A 82 -0.442 5.566 6.505 1.00 1.00 H new ATOM 0 HD11 ILE A 82 -1.292 8.950 5.589 1.00 1.00 H new ATOM 0 HD12 ILE A 82 -0.401 7.592 6.318 1.00 1.00 H new ATOM 0 HD13 ILE A 82 -1.233 7.376 4.760 1.00 1.00 H new ATOM 164 N VAL A 83 -2.189 2.945 4.907 1.00 1.00 N ATOM 165 CA VAL A 83 -2.202 1.493 4.980 1.00 1.00 C ATOM 166 C VAL A 83 -1.375 1.039 6.183 1.00 1.00 C ATOM 167 O VAL A 83 -0.167 1.269 6.233 1.00 1.00 O ATOM 168 CB VAL A 83 -1.713 0.898 3.658 1.00 1.00 C ATOM 169 CG1 VAL A 83 -1.748 -0.631 3.698 1.00 1.00 C ATOM 170 CG2 VAL A 83 -2.528 1.434 2.479 1.00 1.00 C ATOM 0 H VAL A 83 -1.457 3.336 4.313 1.00 1.00 H new ATOM 0 HA VAL A 83 -3.218 1.127 5.129 1.00 1.00 H new ATOM 0 HB VAL A 83 -0.677 1.206 3.516 1.00 1.00 H new ATOM 0 HG11 VAL A 83 -1.395 -1.028 2.746 1.00 1.00 H new ATOM 0 HG12 VAL A 83 -1.104 -0.989 4.501 1.00 1.00 H new ATOM 0 HG13 VAL A 83 -2.770 -0.967 3.875 1.00 1.00 H new ATOM 0 HG21 VAL A 83 -2.159 0.995 1.552 1.00 1.00 H new ATOM 0 HG22 VAL A 83 -3.577 1.171 2.613 1.00 1.00 H new ATOM 0 HG23 VAL A 83 -2.429 2.518 2.431 1.00 1.00 H new ATOM 180 N ARG A 84 -2.056 0.403 7.124 1.00 1.00 N ATOM 181 CA ARG A 84 -1.398 -0.086 8.325 1.00 1.00 C ATOM 182 C ARG A 84 -1.234 -1.606 8.259 1.00 1.00 C ATOM 183 O ARG A 84 -2.214 -2.334 8.116 1.00 1.00 O ATOM 184 CB ARG A 84 -2.195 0.279 9.578 1.00 1.00 C ATOM 185 CG ARG A 84 -2.216 1.794 9.792 1.00 1.00 C ATOM 186 CD ARG A 84 -2.724 2.143 11.192 1.00 1.00 C ATOM 187 NE ARG A 84 -2.893 3.609 11.319 1.00 1.00 N ATOM 188 CZ ARG A 84 -3.468 4.215 12.380 1.00 1.00 C ATOM 189 NH1 ARG A 84 -3.935 3.487 13.416 1.00 1.00 N ATOM 190 NH2 ARG A 84 -3.568 5.531 12.387 1.00 1.00 N ATOM 0 H ARG A 84 -3.057 0.214 7.080 1.00 1.00 H new ATOM 0 HA ARG A 84 -0.418 0.387 8.381 1.00 1.00 H new ATOM 0 HB2 ARG A 84 -3.215 -0.093 9.486 1.00 1.00 H new ATOM 0 HB3 ARG A 84 -1.755 -0.209 10.448 1.00 1.00 H new ATOM 0 HG2 ARG A 84 -1.213 2.198 9.654 1.00 1.00 H new ATOM 0 HG3 ARG A 84 -2.854 2.262 9.043 1.00 1.00 H new ATOM 0 HD2 ARG A 84 -3.674 1.642 11.379 1.00 1.00 H new ATOM 0 HD3 ARG A 84 -2.021 1.783 11.943 1.00 1.00 H new ATOM 0 HE ARG A 84 -2.554 4.197 10.558 1.00 1.00 H new ATOM 0 HH11 ARG A 84 -3.855 2.470 13.402 1.00 1.00 H new ATOM 0 HH12 ARG A 84 -4.368 3.954 14.213 1.00 1.00 H new ATOM 0 HH21 ARG A 84 -3.214 6.074 11.599 1.00 1.00 H new ATOM 0 HH22 ARG A 84 -3.999 6.005 13.180 1.00 1.00 H new ATOM 199 N SER A 85 0.014 -2.039 8.364 1.00 1.00 N ATOM 200 CA SER A 85 0.319 -3.459 8.318 1.00 1.00 C ATOM 201 C SER A 85 -0.648 -4.232 9.216 1.00 1.00 C ATOM 202 O SER A 85 -0.532 -4.193 10.439 1.00 1.00 O ATOM 203 CB SER A 85 1.765 -3.725 8.744 1.00 1.00 C ATOM 204 OG SER A 85 2.218 -5.008 8.322 1.00 1.00 O ATOM 0 H SER A 85 0.825 -1.432 8.481 1.00 1.00 H new ATOM 0 HA SER A 85 0.202 -3.801 7.290 1.00 1.00 H new ATOM 0 HB2 SER A 85 2.414 -2.956 8.325 1.00 1.00 H new ATOM 0 HB3 SER A 85 1.843 -3.652 9.829 1.00 1.00 H new ATOM 0 HG SER A 85 1.905 -5.689 8.953 1.00 1.00 H new ATOM 209 N PRO A 86 -1.608 -4.934 8.555 1.00 1.00 N ATOM 210 CA PRO A 86 -2.597 -5.715 9.279 1.00 1.00 C ATOM 211 C PRO A 86 -1.982 -7.004 9.828 1.00 1.00 C ATOM 212 O PRO A 86 -2.669 -7.802 10.465 1.00 1.00 O ATOM 213 CB PRO A 86 -3.711 -5.968 8.276 1.00 1.00 C ATOM 214 CG PRO A 86 -3.101 -5.723 6.906 1.00 1.00 C ATOM 215 CD PRO A 86 -1.777 -5.003 7.106 1.00 1.00 C ATOM 0 HA PRO A 86 -2.981 -5.197 10.157 1.00 1.00 H new ATOM 0 HB2 PRO A 86 -4.088 -6.987 8.359 1.00 1.00 H new ATOM 0 HB3 PRO A 86 -4.555 -5.301 8.453 1.00 1.00 H new ATOM 0 HG2 PRO A 86 -2.947 -6.667 6.383 1.00 1.00 H new ATOM 0 HG3 PRO A 86 -3.772 -5.123 6.291 1.00 1.00 H new ATOM 0 HD2 PRO A 86 -0.956 -5.546 6.637 1.00 1.00 H new ATOM 0 HD3 PRO A 86 -1.796 -4.008 6.662 1.00 1.00 H new ATOM 220 N MET A 87 -0.695 -7.168 9.561 1.00 1.00 N ATOM 221 CA MET A 87 0.021 -8.347 10.020 1.00 1.00 C ATOM 222 C MET A 87 1.530 -8.101 10.034 1.00 1.00 C ATOM 223 O MET A 87 2.083 -7.558 9.078 1.00 1.00 O ATOM 224 CB MET A 87 -0.297 -9.528 9.101 1.00 1.00 C ATOM 225 CG MET A 87 -0.393 -9.076 7.642 1.00 1.00 C ATOM 226 SD MET A 87 -0.811 -10.464 6.600 1.00 1.00 S ATOM 227 CE MET A 87 -2.299 -9.840 5.837 1.00 1.00 C ATOM 0 H MET A 87 -0.129 -6.504 9.033 1.00 1.00 H new ATOM 0 HA MET A 87 -0.300 -8.571 11.037 1.00 1.00 H new ATOM 0 HB2 MET A 87 0.477 -10.289 9.200 1.00 1.00 H new ATOM 0 HB3 MET A 87 -1.237 -9.988 9.406 1.00 1.00 H new ATOM 0 HG2 MET A 87 -1.148 -8.296 7.543 1.00 1.00 H new ATOM 0 HG3 MET A 87 0.556 -8.644 7.323 1.00 1.00 H new ATOM 0 HE1 MET A 87 -2.696 -10.587 5.150 1.00 1.00 H new ATOM 0 HE2 MET A 87 -3.040 -9.625 6.607 1.00 1.00 H new ATOM 0 HE3 MET A 87 -2.071 -8.927 5.288 1.00 1.00 H new ATOM 235 N VAL A 88 2.156 -8.515 11.126 1.00 1.00 N ATOM 236 CA VAL A 88 3.591 -8.347 11.276 1.00 1.00 C ATOM 237 C VAL A 88 4.313 -9.264 10.285 1.00 1.00 C ATOM 238 O VAL A 88 3.908 -10.407 10.082 1.00 1.00 O ATOM 239 CB VAL A 88 3.998 -8.598 12.729 1.00 1.00 C ATOM 240 CG1 VAL A 88 5.414 -8.082 12.998 1.00 1.00 C ATOM 241 CG2 VAL A 88 2.993 -7.971 13.696 1.00 1.00 C ATOM 0 H VAL A 88 1.695 -8.967 11.916 1.00 1.00 H new ATOM 0 HA VAL A 88 3.883 -7.323 11.044 1.00 1.00 H new ATOM 0 HB VAL A 88 3.996 -9.675 12.897 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.679 -8.273 14.038 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.119 -8.595 12.344 1.00 1.00 H new ATOM 0 HG13 VAL A 88 5.454 -7.010 12.804 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.306 -8.164 14.722 1.00 1.00 H new ATOM 0 HG22 VAL A 88 2.948 -6.895 13.527 1.00 1.00 H new ATOM 0 HG23 VAL A 88 2.008 -8.406 13.529 1.00 1.00 H new ATOM 251 N GLY A 89 5.372 -8.727 9.696 1.00 1.00 N ATOM 252 CA GLY A 89 6.155 -9.482 8.732 1.00 1.00 C ATOM 253 C GLY A 89 6.986 -8.549 7.849 1.00 1.00 C ATOM 254 O GLY A 89 7.791 -7.768 8.352 1.00 1.00 O ATOM 0 H GLY A 89 5.706 -7.779 9.868 1.00 1.00 H new ATOM 0 HA2 GLY A 89 6.814 -10.175 9.256 1.00 1.00 H new ATOM 0 HA3 GLY A 89 5.491 -10.082 8.109 1.00 1.00 H new ATOM 258 N THR A 90 6.760 -8.662 6.548 1.00 1.00 N ATOM 259 CA THR A 90 7.478 -7.838 5.591 1.00 1.00 C ATOM 260 C THR A 90 6.501 -7.187 4.608 1.00 1.00 C ATOM 261 O THR A 90 5.326 -7.545 4.569 1.00 1.00 O ATOM 262 CB THR A 90 8.532 -8.714 4.910 1.00 1.00 C ATOM 263 OG1 THR A 90 9.414 -9.082 5.967 1.00 1.00 O ATOM 264 CG2 THR A 90 9.416 -7.922 3.945 1.00 1.00 C ATOM 0 H THR A 90 6.090 -9.311 6.135 1.00 1.00 H new ATOM 0 HA THR A 90 7.990 -7.013 6.086 1.00 1.00 H new ATOM 0 HB THR A 90 8.038 -9.522 4.370 1.00 1.00 H new ATOM 0 HG1 THR A 90 10.128 -9.653 5.614 1.00 1.00 H new ATOM 0 HG21 THR A 90 10.146 -8.590 3.489 1.00 1.00 H new ATOM 0 HG22 THR A 90 8.797 -7.476 3.167 1.00 1.00 H new ATOM 0 HG23 THR A 90 9.936 -7.135 4.491 1.00 1.00 H new ATOM 272 N PHE A 91 7.025 -6.244 3.841 1.00 1.00 N ATOM 273 CA PHE A 91 6.214 -5.540 2.861 1.00 1.00 C ATOM 274 C PHE A 91 6.985 -5.339 1.555 1.00 1.00 C ATOM 275 O PHE A 91 8.171 -5.013 1.572 1.00 1.00 O ATOM 276 CB PHE A 91 5.880 -4.172 3.458 1.00 1.00 C ATOM 277 CG PHE A 91 5.232 -3.202 2.467 1.00 1.00 C ATOM 278 CD1 PHE A 91 5.965 -2.682 1.446 1.00 1.00 C ATOM 279 CD2 PHE A 91 3.923 -2.861 2.607 1.00 1.00 C ATOM 280 CE1 PHE A 91 5.363 -1.783 0.527 1.00 1.00 C ATOM 281 CE2 PHE A 91 3.321 -1.961 1.689 1.00 1.00 C ATOM 282 CZ PHE A 91 4.054 -1.442 0.667 1.00 1.00 C ATOM 0 H PHE A 91 8.001 -5.950 3.877 1.00 1.00 H new ATOM 0 HA PHE A 91 5.316 -6.116 2.637 1.00 1.00 H new ATOM 0 HB2 PHE A 91 5.209 -4.311 4.306 1.00 1.00 H new ATOM 0 HB3 PHE A 91 6.795 -3.723 3.845 1.00 1.00 H new ATOM 0 HD1 PHE A 91 7.005 -2.953 1.335 1.00 1.00 H new ATOM 0 HD2 PHE A 91 3.341 -3.275 3.417 1.00 1.00 H new ATOM 0 HE1 PHE A 91 5.945 -1.370 -0.284 1.00 1.00 H new ATOM 0 HE2 PHE A 91 2.282 -1.688 1.802 1.00 1.00 H new ATOM 0 HZ PHE A 91 3.596 -0.759 -0.033 1.00 1.00 H new ATOM 291 N TYR A 92 6.279 -5.542 0.452 1.00 1.00 N ATOM 292 CA TYR A 92 6.880 -5.387 -0.861 1.00 1.00 C ATOM 293 C TYR A 92 6.023 -4.489 -1.755 1.00 1.00 C ATOM 294 O TYR A 92 4.840 -4.285 -1.484 1.00 1.00 O ATOM 295 CB TYR A 92 6.935 -6.790 -1.469 1.00 1.00 C ATOM 296 CG TYR A 92 7.983 -7.703 -0.831 1.00 1.00 C ATOM 297 CD1 TYR A 92 9.321 -7.525 -1.120 1.00 1.00 C ATOM 298 CD2 TYR A 92 7.592 -8.706 0.032 1.00 1.00 C ATOM 299 CE1 TYR A 92 10.308 -8.385 -0.521 1.00 1.00 C ATOM 300 CE2 TYR A 92 8.579 -9.566 0.632 1.00 1.00 C ATOM 301 CZ TYR A 92 9.888 -9.363 0.326 1.00 1.00 C ATOM 302 OH TYR A 92 10.820 -10.175 0.893 1.00 1.00 O ATOM 0 H TYR A 92 5.296 -5.813 0.441 1.00 1.00 H new ATOM 0 HA TYR A 92 7.865 -4.928 -0.779 1.00 1.00 H new ATOM 0 HB2 TYR A 92 5.954 -7.256 -1.372 1.00 1.00 H new ATOM 0 HB3 TYR A 92 7.143 -6.705 -2.536 1.00 1.00 H new ATOM 0 HD1 TYR A 92 9.628 -6.740 -1.796 1.00 1.00 H new ATOM 0 HD2 TYR A 92 6.545 -8.846 0.258 1.00 1.00 H new ATOM 0 HE1 TYR A 92 11.358 -8.257 -0.739 1.00 1.00 H new ATOM 0 HE2 TYR A 92 8.286 -10.354 1.310 1.00 1.00 H new ATOM 0 HH TYR A 92 10.376 -10.826 1.476 1.00 1.00 H new ATOM 311 N ARG A 93 6.651 -3.978 -2.804 1.00 1.00 N ATOM 312 CA ARG A 93 5.960 -3.108 -3.740 1.00 1.00 C ATOM 313 C ARG A 93 5.781 -3.812 -5.086 1.00 1.00 C ATOM 314 O ARG A 93 5.003 -3.363 -5.927 1.00 1.00 O ATOM 315 CB ARG A 93 6.731 -1.804 -3.953 1.00 1.00 C ATOM 316 CG ARG A 93 7.151 -1.191 -2.615 1.00 1.00 C ATOM 317 CD ARG A 93 6.264 0.005 -2.258 1.00 1.00 C ATOM 318 NE ARG A 93 6.170 0.927 -3.412 1.00 1.00 N ATOM 319 CZ ARG A 93 7.192 1.685 -3.860 1.00 1.00 C ATOM 320 NH1 ARG A 93 8.398 1.636 -3.254 1.00 1.00 N ATOM 321 NH2 ARG A 93 6.997 2.474 -4.900 1.00 1.00 N ATOM 0 H ARG A 93 7.631 -4.150 -3.026 1.00 1.00 H new ATOM 0 HA ARG A 93 4.984 -2.874 -3.316 1.00 1.00 H new ATOM 0 HB2 ARG A 93 7.614 -1.995 -4.563 1.00 1.00 H new ATOM 0 HB3 ARG A 93 6.111 -1.096 -4.503 1.00 1.00 H new ATOM 0 HG2 ARG A 93 7.086 -1.944 -1.829 1.00 1.00 H new ATOM 0 HG3 ARG A 93 8.192 -0.873 -2.667 1.00 1.00 H new ATOM 0 HD2 ARG A 93 5.269 -0.341 -1.976 1.00 1.00 H new ATOM 0 HD3 ARG A 93 6.676 0.529 -1.396 1.00 1.00 H new ATOM 0 HE ARG A 93 5.276 0.993 -3.899 1.00 1.00 H new ATOM 0 HH11 ARG A 93 8.541 1.023 -2.452 1.00 1.00 H new ATOM 0 HH12 ARG A 93 9.166 2.212 -3.599 1.00 1.00 H new ATOM 0 HH21 ARG A 93 6.084 2.504 -5.353 1.00 1.00 H new ATOM 0 HH22 ARG A 93 7.760 3.053 -5.251 1.00 1.00 H new ATOM 330 N THR A 94 6.514 -4.904 -5.250 1.00 1.00 N ATOM 331 CA THR A 94 6.446 -5.674 -6.479 1.00 1.00 C ATOM 332 C THR A 94 6.344 -7.169 -6.168 1.00 1.00 C ATOM 333 O THR A 94 6.767 -7.615 -5.102 1.00 1.00 O ATOM 334 CB THR A 94 7.664 -5.312 -7.332 1.00 1.00 C ATOM 335 OG1 THR A 94 8.775 -5.566 -6.475 1.00 1.00 O ATOM 336 CG2 THR A 94 7.751 -3.813 -7.622 1.00 1.00 C ATOM 0 H THR A 94 7.158 -5.273 -4.551 1.00 1.00 H new ATOM 0 HA THR A 94 5.549 -5.431 -7.048 1.00 1.00 H new ATOM 0 HB THR A 94 7.625 -5.861 -8.273 1.00 1.00 H new ATOM 0 HG1 THR A 94 9.337 -6.267 -6.867 1.00 1.00 H new ATOM 0 HG21 THR A 94 8.633 -3.611 -8.230 1.00 1.00 H new ATOM 0 HG22 THR A 94 6.858 -3.494 -8.160 1.00 1.00 H new ATOM 0 HG23 THR A 94 7.824 -3.264 -6.683 1.00 1.00 H new ATOM 344 N PRO A 95 5.766 -7.921 -7.142 1.00 1.00 N ATOM 345 CA PRO A 95 5.604 -9.356 -6.982 1.00 1.00 C ATOM 346 C PRO A 95 6.938 -10.082 -7.164 1.00 1.00 C ATOM 347 O PRO A 95 7.150 -11.152 -6.595 1.00 1.00 O ATOM 348 CB PRO A 95 4.566 -9.752 -8.019 1.00 1.00 C ATOM 349 CG PRO A 95 4.528 -8.615 -9.027 1.00 1.00 C ATOM 350 CD PRO A 95 5.254 -7.427 -8.417 1.00 1.00 C ATOM 0 HA PRO A 95 5.274 -9.633 -5.981 1.00 1.00 H new ATOM 0 HB2 PRO A 95 4.834 -10.692 -8.501 1.00 1.00 H new ATOM 0 HB3 PRO A 95 3.589 -9.898 -7.558 1.00 1.00 H new ATOM 0 HG2 PRO A 95 5.005 -8.916 -9.960 1.00 1.00 H new ATOM 0 HG3 PRO A 95 3.498 -8.351 -9.266 1.00 1.00 H new ATOM 0 HD2 PRO A 95 6.063 -7.083 -9.062 1.00 1.00 H new ATOM 0 HD3 PRO A 95 4.580 -6.582 -8.273 1.00 1.00 H new ATOM 355 N SER A 96 7.804 -9.472 -7.961 1.00 1.00 N ATOM 356 CA SER A 96 9.112 -10.048 -8.225 1.00 1.00 C ATOM 357 C SER A 96 10.139 -8.935 -8.442 1.00 1.00 C ATOM 358 O SER A 96 9.797 -7.754 -8.405 1.00 1.00 O ATOM 359 CB SER A 96 9.069 -10.976 -9.441 1.00 1.00 C ATOM 360 OG SER A 96 9.549 -12.281 -9.132 1.00 1.00 O ATOM 0 H SER A 96 7.625 -8.585 -8.432 1.00 1.00 H new ATOM 0 HA SER A 96 9.406 -10.641 -7.359 1.00 1.00 H new ATOM 0 HB2 SER A 96 8.045 -11.044 -9.810 1.00 1.00 H new ATOM 0 HB3 SER A 96 9.670 -10.549 -10.244 1.00 1.00 H new ATOM 0 HG SER A 96 9.939 -12.685 -9.935 1.00 1.00 H new ATOM 365 N PRO A 97 11.409 -9.361 -8.670 1.00 1.00 N ATOM 366 CA PRO A 97 12.489 -8.414 -8.892 1.00 1.00 C ATOM 367 C PRO A 97 12.405 -7.807 -10.294 1.00 1.00 C ATOM 368 O PRO A 97 12.608 -6.606 -10.468 1.00 1.00 O ATOM 369 CB PRO A 97 13.763 -9.210 -8.665 1.00 1.00 C ATOM 370 CG PRO A 97 13.368 -10.673 -8.781 1.00 1.00 C ATOM 371 CD PRO A 97 11.851 -10.752 -8.720 1.00 1.00 C ATOM 0 HA PRO A 97 12.444 -7.559 -8.218 1.00 1.00 H new ATOM 0 HB2 PRO A 97 14.522 -8.951 -9.403 1.00 1.00 H new ATOM 0 HB3 PRO A 97 14.187 -8.997 -7.684 1.00 1.00 H new ATOM 0 HG2 PRO A 97 13.735 -11.095 -9.717 1.00 1.00 H new ATOM 0 HG3 PRO A 97 13.813 -11.254 -7.973 1.00 1.00 H new ATOM 0 HD2 PRO A 97 11.446 -11.265 -9.592 1.00 1.00 H new ATOM 0 HD3 PRO A 97 11.518 -11.305 -7.842 1.00 1.00 H new ATOM 376 N ASP A 98 12.106 -8.665 -11.259 1.00 1.00 N ATOM 377 CA ASP A 98 11.993 -8.228 -12.640 1.00 1.00 C ATOM 378 C ASP A 98 10.516 -8.048 -12.993 1.00 1.00 C ATOM 379 O ASP A 98 10.102 -8.333 -14.117 1.00 1.00 O ATOM 380 CB ASP A 98 12.584 -9.267 -13.596 1.00 1.00 C ATOM 381 CG ASP A 98 11.647 -10.422 -13.956 1.00 1.00 C ATOM 382 OD1 ASP A 98 11.178 -11.160 -13.078 1.00 1.00 O ATOM 383 OD2 ASP A 98 11.401 -10.551 -15.216 1.00 1.00 O ATOM 0 H ASP A 98 11.939 -9.660 -11.111 1.00 1.00 H new ATOM 0 HA ASP A 98 12.539 -7.290 -12.743 1.00 1.00 H new ATOM 0 HB2 ASP A 98 12.885 -8.764 -14.515 1.00 1.00 H new ATOM 0 HB3 ASP A 98 13.488 -9.679 -13.147 1.00 1.00 H new ATOM 388 N ALA A 99 9.759 -7.574 -12.015 1.00 1.00 N ATOM 389 CA ALA A 99 8.337 -7.351 -12.208 1.00 1.00 C ATOM 390 C ALA A 99 8.024 -5.867 -12.004 1.00 1.00 C ATOM 391 O ALA A 99 8.746 -5.169 -11.293 1.00 1.00 O ATOM 392 CB ALA A 99 7.545 -8.250 -11.257 1.00 1.00 C ATOM 0 H ALA A 99 10.105 -7.338 -11.085 1.00 1.00 H new ATOM 0 HA ALA A 99 8.043 -7.613 -13.224 1.00 1.00 H new ATOM 0 HB1 ALA A 99 6.478 -8.082 -11.402 1.00 1.00 H new ATOM 0 HB2 ALA A 99 7.780 -9.294 -11.463 1.00 1.00 H new ATOM 0 HB3 ALA A 99 7.812 -8.015 -10.227 1.00 1.00 H new ATOM 398 N LYS A 100 6.947 -5.429 -12.639 1.00 1.00 N ATOM 399 CA LYS A 100 6.530 -4.040 -12.536 1.00 1.00 C ATOM 400 C LYS A 100 6.086 -3.751 -11.100 1.00 1.00 C ATOM 401 O LYS A 100 5.885 -4.673 -10.312 1.00 1.00 O ATOM 402 CB LYS A 100 5.464 -3.722 -13.585 1.00 1.00 C ATOM 403 CG LYS A 100 5.732 -4.479 -14.888 1.00 1.00 C ATOM 404 CD LYS A 100 5.071 -3.779 -16.075 1.00 1.00 C ATOM 405 CE LYS A 100 3.570 -4.076 -16.119 1.00 1.00 C ATOM 406 NZ LYS A 100 3.302 -5.270 -16.951 1.00 1.00 N ATOM 0 H LYS A 100 6.350 -6.011 -13.227 1.00 1.00 H new ATOM 0 HA LYS A 100 7.365 -3.374 -12.752 1.00 1.00 H new ATOM 0 HB2 LYS A 100 4.480 -3.990 -13.201 1.00 1.00 H new ATOM 0 HB3 LYS A 100 5.449 -2.650 -13.780 1.00 1.00 H new ATOM 0 HG2 LYS A 100 6.807 -4.551 -15.056 1.00 1.00 H new ATOM 0 HG3 LYS A 100 5.353 -5.498 -14.805 1.00 1.00 H new ATOM 0 HD2 LYS A 100 5.231 -2.703 -16.003 1.00 1.00 H new ATOM 0 HD3 LYS A 100 5.538 -4.109 -17.003 1.00 1.00 H new ATOM 0 HE2 LYS A 100 3.196 -4.238 -15.108 1.00 1.00 H new ATOM 0 HE3 LYS A 100 3.035 -3.217 -16.523 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 2.279 -5.457 -16.970 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 3.641 -5.101 -17.920 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 3.797 -6.092 -16.549 1.00 1.00 H new ATOM 415 N ALA A 101 5.946 -2.467 -10.806 1.00 1.00 N ATOM 416 CA ALA A 101 5.530 -2.046 -9.479 1.00 1.00 C ATOM 417 C ALA A 101 4.001 -2.002 -9.419 1.00 1.00 C ATOM 418 O ALA A 101 3.355 -1.471 -10.320 1.00 1.00 O ATOM 419 CB ALA A 101 6.164 -0.692 -9.151 1.00 1.00 C ATOM 0 H ALA A 101 6.113 -1.705 -11.463 1.00 1.00 H new ATOM 0 HA ALA A 101 5.870 -2.757 -8.726 1.00 1.00 H new ATOM 0 HB1 ALA A 101 5.852 -0.376 -8.156 1.00 1.00 H new ATOM 0 HB2 ALA A 101 7.250 -0.782 -9.179 1.00 1.00 H new ATOM 0 HB3 ALA A 101 5.842 0.048 -9.884 1.00 1.00 H new ATOM 425 N PHE A 102 3.467 -2.571 -8.347 1.00 1.00 N ATOM 426 CA PHE A 102 2.027 -2.604 -8.158 1.00 1.00 C ATOM 427 C PHE A 102 1.437 -1.193 -8.186 1.00 1.00 C ATOM 428 O PHE A 102 0.359 -0.976 -8.738 1.00 1.00 O ATOM 429 CB PHE A 102 1.771 -3.224 -6.783 1.00 1.00 C ATOM 430 CG PHE A 102 1.742 -4.753 -6.785 1.00 1.00 C ATOM 431 CD1 PHE A 102 0.756 -5.414 -7.449 1.00 1.00 C ATOM 432 CD2 PHE A 102 2.702 -5.453 -6.122 1.00 1.00 C ATOM 433 CE1 PHE A 102 0.728 -6.833 -7.452 1.00 1.00 C ATOM 434 CE2 PHE A 102 2.674 -6.873 -6.124 1.00 1.00 C ATOM 435 CZ PHE A 102 1.688 -7.532 -6.789 1.00 1.00 C ATOM 0 H PHE A 102 4.006 -3.012 -7.602 1.00 1.00 H new ATOM 0 HA PHE A 102 1.560 -3.179 -8.957 1.00 1.00 H new ATOM 0 HB2 PHE A 102 2.545 -2.887 -6.094 1.00 1.00 H new ATOM 0 HB3 PHE A 102 0.820 -2.853 -6.400 1.00 1.00 H new ATOM 0 HD1 PHE A 102 -0.007 -4.858 -7.975 1.00 1.00 H new ATOM 0 HD2 PHE A 102 3.485 -4.929 -5.594 1.00 1.00 H new ATOM 0 HE1 PHE A 102 -0.055 -7.357 -7.980 1.00 1.00 H new ATOM 0 HE2 PHE A 102 3.436 -7.429 -5.598 1.00 1.00 H new ATOM 0 HZ PHE A 102 1.667 -8.612 -6.791 1.00 1.00 H new ATOM 444 N ILE A 103 2.169 -0.267 -7.583 1.00 1.00 N ATOM 445 CA ILE A 103 1.732 1.117 -7.532 1.00 1.00 C ATOM 446 C ILE A 103 2.951 2.036 -7.633 1.00 1.00 C ATOM 447 O ILE A 103 3.586 2.345 -6.626 1.00 1.00 O ATOM 448 CB ILE A 103 0.878 1.364 -6.287 1.00 1.00 C ATOM 449 CG1 ILE A 103 0.878 2.846 -5.907 1.00 1.00 C ATOM 450 CG2 ILE A 103 1.331 0.475 -5.127 1.00 1.00 C ATOM 451 CD1 ILE A 103 -0.505 3.286 -5.420 1.00 1.00 C ATOM 0 H ILE A 103 3.062 -0.449 -7.126 1.00 1.00 H new ATOM 0 HA ILE A 103 1.089 1.345 -8.382 1.00 1.00 H new ATOM 0 HB ILE A 103 -0.152 1.091 -6.519 1.00 1.00 H new ATOM 0 HG12 ILE A 103 1.617 3.025 -5.126 1.00 1.00 H new ATOM 0 HG13 ILE A 103 1.173 3.446 -6.768 1.00 1.00 H new ATOM 0 HG21 ILE A 103 0.708 0.670 -4.254 1.00 1.00 H new ATOM 0 HG22 ILE A 103 1.237 -0.573 -5.413 1.00 1.00 H new ATOM 0 HG23 ILE A 103 2.371 0.693 -4.886 1.00 1.00 H new ATOM 0 HD11 ILE A 103 -0.478 4.343 -5.156 1.00 1.00 H new ATOM 0 HD12 ILE A 103 -1.237 3.128 -6.212 1.00 1.00 H new ATOM 0 HD13 ILE A 103 -0.786 2.700 -4.545 1.00 1.00 H new ATOM 462 N GLU A 104 3.242 2.448 -8.859 1.00 1.00 N ATOM 463 CA GLU A 104 4.374 3.324 -9.105 1.00 1.00 C ATOM 464 C GLU A 104 4.012 4.769 -8.753 1.00 1.00 C ATOM 465 O GLU A 104 3.029 5.308 -9.262 1.00 1.00 O ATOM 466 CB GLU A 104 4.848 3.215 -10.556 1.00 1.00 C ATOM 467 CG GLU A 104 6.284 2.694 -10.626 1.00 1.00 C ATOM 468 CD GLU A 104 7.103 3.479 -11.653 1.00 1.00 C ATOM 469 OE1 GLU A 104 7.303 3.004 -12.780 1.00 1.00 O ATOM 470 OE2 GLU A 104 7.536 4.623 -11.245 1.00 1.00 O ATOM 0 H GLU A 104 2.713 2.191 -9.692 1.00 1.00 H new ATOM 0 HA GLU A 104 5.198 3.009 -8.465 1.00 1.00 H new ATOM 0 HB2 GLU A 104 4.188 2.547 -11.109 1.00 1.00 H new ATOM 0 HB3 GLU A 104 4.788 4.192 -11.036 1.00 1.00 H new ATOM 0 HG2 GLU A 104 6.752 2.774 -9.645 1.00 1.00 H new ATOM 0 HG3 GLU A 104 6.279 1.637 -10.891 1.00 1.00 H new ATOM 476 N VAL A 105 4.824 5.356 -7.887 1.00 1.00 N ATOM 477 CA VAL A 105 4.602 6.727 -7.461 1.00 1.00 C ATOM 478 C VAL A 105 4.165 7.565 -8.665 1.00 1.00 C ATOM 479 O VAL A 105 4.925 7.732 -9.618 1.00 1.00 O ATOM 480 CB VAL A 105 5.857 7.273 -6.777 1.00 1.00 C ATOM 481 CG1 VAL A 105 5.637 8.707 -6.292 1.00 1.00 C ATOM 482 CG2 VAL A 105 6.292 6.365 -5.625 1.00 1.00 C ATOM 0 H VAL A 105 5.638 4.906 -7.468 1.00 1.00 H new ATOM 0 HA VAL A 105 3.801 6.773 -6.724 1.00 1.00 H new ATOM 0 HB VAL A 105 6.660 7.288 -7.513 1.00 1.00 H new ATOM 0 HG11 VAL A 105 6.544 9.071 -5.810 1.00 1.00 H new ATOM 0 HG12 VAL A 105 5.397 9.346 -7.142 1.00 1.00 H new ATOM 0 HG13 VAL A 105 4.813 8.727 -5.578 1.00 1.00 H new ATOM 0 HG21 VAL A 105 7.186 6.776 -5.156 1.00 1.00 H new ATOM 0 HG22 VAL A 105 5.491 6.303 -4.888 1.00 1.00 H new ATOM 0 HG23 VAL A 105 6.509 5.368 -6.009 1.00 1.00 H new ATOM 492 N GLY A 106 2.943 8.069 -8.582 1.00 1.00 N ATOM 493 CA GLY A 106 2.396 8.886 -9.653 1.00 1.00 C ATOM 494 C GLY A 106 1.226 8.178 -10.339 1.00 1.00 C ATOM 495 O GLY A 106 0.790 8.590 -11.413 1.00 1.00 O ATOM 0 H GLY A 106 2.316 7.928 -7.790 1.00 1.00 H new ATOM 0 HA2 GLY A 106 2.062 9.843 -9.251 1.00 1.00 H new ATOM 0 HA3 GLY A 106 3.175 9.102 -10.385 1.00 1.00 H new ATOM 499 N GLN A 107 0.750 7.124 -9.691 1.00 1.00 N ATOM 500 CA GLN A 107 -0.361 6.356 -10.225 1.00 1.00 C ATOM 501 C GLN A 107 -1.512 6.317 -9.219 1.00 1.00 C ATOM 502 O GLN A 107 -1.357 6.746 -8.076 1.00 1.00 O ATOM 503 CB GLN A 107 0.084 4.942 -10.604 1.00 1.00 C ATOM 504 CG GLN A 107 -0.943 4.273 -11.521 1.00 1.00 C ATOM 505 CD GLN A 107 -0.272 3.251 -12.442 1.00 1.00 C ATOM 506 OE1 GLN A 107 -0.258 3.385 -13.655 1.00 1.00 O ATOM 507 NE2 GLN A 107 0.282 2.226 -11.801 1.00 1.00 N ATOM 0 H GLN A 107 1.114 6.784 -8.801 1.00 1.00 H new ATOM 0 HA GLN A 107 -0.714 6.847 -11.132 1.00 1.00 H new ATOM 0 HB2 GLN A 107 1.052 4.983 -11.104 1.00 1.00 H new ATOM 0 HB3 GLN A 107 0.216 4.344 -9.702 1.00 1.00 H new ATOM 0 HG2 GLN A 107 -1.706 3.780 -10.919 1.00 1.00 H new ATOM 0 HG3 GLN A 107 -1.449 5.030 -12.120 1.00 1.00 H new ATOM 0 HE21 GLN A 107 0.234 2.175 -10.783 1.00 1.00 H new ATOM 0 HE22 GLN A 107 0.755 1.491 -12.327 1.00 1.00 H new ATOM 514 N LYS A 108 -2.641 5.799 -9.678 1.00 1.00 N ATOM 515 CA LYS A 108 -3.818 5.698 -8.833 1.00 1.00 C ATOM 516 C LYS A 108 -4.198 4.226 -8.667 1.00 1.00 C ATOM 517 O LYS A 108 -3.552 3.347 -9.236 1.00 1.00 O ATOM 518 CB LYS A 108 -4.950 6.568 -9.384 1.00 1.00 C ATOM 519 CG LYS A 108 -5.547 5.952 -10.651 1.00 1.00 C ATOM 520 CD LYS A 108 -7.071 5.871 -10.555 1.00 1.00 C ATOM 521 CE LYS A 108 -7.667 5.235 -11.813 1.00 1.00 C ATOM 522 NZ LYS A 108 -8.976 4.614 -11.510 1.00 1.00 N ATOM 0 H LYS A 108 -2.766 5.444 -10.626 1.00 1.00 H new ATOM 0 HA LYS A 108 -3.605 6.086 -7.837 1.00 1.00 H new ATOM 0 HB2 LYS A 108 -5.728 6.681 -8.629 1.00 1.00 H new ATOM 0 HB3 LYS A 108 -4.572 7.567 -9.604 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -5.265 6.549 -11.518 1.00 1.00 H new ATOM 0 HG3 LYS A 108 -5.135 4.954 -10.804 1.00 1.00 H new ATOM 0 HD2 LYS A 108 -7.353 5.287 -9.679 1.00 1.00 H new ATOM 0 HD3 LYS A 108 -7.484 6.870 -10.418 1.00 1.00 H new ATOM 0 HE2 LYS A 108 -7.788 5.992 -12.588 1.00 1.00 H new ATOM 0 HE3 LYS A 108 -6.983 4.483 -12.206 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 -9.366 4.187 -12.374 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 -8.852 3.878 -10.786 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 -9.631 5.340 -11.156 1.00 1.00 H new ATOM 531 N VAL A 109 -5.245 4.001 -7.888 1.00 1.00 N ATOM 532 CA VAL A 109 -5.720 2.650 -7.640 1.00 1.00 C ATOM 533 C VAL A 109 -7.207 2.693 -7.287 1.00 1.00 C ATOM 534 O VAL A 109 -7.668 3.631 -6.639 1.00 1.00 O ATOM 535 CB VAL A 109 -4.867 1.986 -6.558 1.00 1.00 C ATOM 536 CG1 VAL A 109 -3.413 1.845 -7.014 1.00 1.00 C ATOM 537 CG2 VAL A 109 -4.954 2.759 -5.240 1.00 1.00 C ATOM 0 H VAL A 109 -5.779 4.733 -7.419 1.00 1.00 H new ATOM 0 HA VAL A 109 -5.617 2.039 -8.537 1.00 1.00 H new ATOM 0 HB VAL A 109 -5.263 0.985 -6.388 1.00 1.00 H new ATOM 0 HG11 VAL A 109 -2.829 1.370 -6.226 1.00 1.00 H new ATOM 0 HG12 VAL A 109 -3.372 1.233 -7.915 1.00 1.00 H new ATOM 0 HG13 VAL A 109 -3.001 2.832 -7.226 1.00 1.00 H new ATOM 0 HG21 VAL A 109 -4.339 2.266 -4.488 1.00 1.00 H new ATOM 0 HG22 VAL A 109 -4.596 3.777 -5.391 1.00 1.00 H new ATOM 0 HG23 VAL A 109 -5.990 2.785 -4.901 1.00 1.00 H new ATOM 547 N ASN A 110 -7.918 1.665 -7.728 1.00 1.00 N ATOM 548 CA ASN A 110 -9.343 1.574 -7.466 1.00 1.00 C ATOM 549 C ASN A 110 -9.626 0.319 -6.638 1.00 1.00 C ATOM 550 O ASN A 110 -8.736 -0.503 -6.428 1.00 1.00 O ATOM 551 CB ASN A 110 -10.137 1.469 -8.771 1.00 1.00 C ATOM 552 CG ASN A 110 -11.507 2.137 -8.634 1.00 1.00 C ATOM 553 OD1 ASN A 110 -12.509 1.283 -8.446 1.00 1.00 O flip ATOM 554 ND2 ASN A 110 -11.645 3.348 -8.696 1.00 1.00 N flip ATOM 0 H ASN A 110 -7.533 0.888 -8.265 1.00 1.00 H new ATOM 0 HA ASN A 110 -9.646 2.474 -6.931 1.00 1.00 H new ATOM 0 HB2 ASN A 110 -9.578 1.940 -9.580 1.00 1.00 H new ATOM 0 HB3 ASN A 110 -10.265 0.420 -9.040 1.00 1.00 H new ATOM 0 HD21 ASN A 110 -10.833 3.947 -8.842 1.00 1.00 H new ATOM 0 HD22 ASN A 110 -12.573 3.761 -8.602 1.00 1.00 H new ATOM 560 N VAL A 111 -10.869 0.212 -6.191 1.00 1.00 N ATOM 561 CA VAL A 111 -11.280 -0.930 -5.392 1.00 1.00 C ATOM 562 C VAL A 111 -11.124 -2.209 -6.217 1.00 1.00 C ATOM 563 O VAL A 111 -11.883 -2.442 -7.155 1.00 1.00 O ATOM 564 CB VAL A 111 -12.706 -0.721 -4.876 1.00 1.00 C ATOM 565 CG1 VAL A 111 -13.376 -2.060 -4.561 1.00 1.00 C ATOM 566 CG2 VAL A 111 -12.717 0.199 -3.654 1.00 1.00 C ATOM 0 H VAL A 111 -11.604 0.897 -6.367 1.00 1.00 H new ATOM 0 HA VAL A 111 -10.642 -1.031 -4.514 1.00 1.00 H new ATOM 0 HB VAL A 111 -13.281 -0.236 -5.665 1.00 1.00 H new ATOM 0 HG11 VAL A 111 -14.388 -1.884 -4.196 1.00 1.00 H new ATOM 0 HG12 VAL A 111 -13.417 -2.668 -5.465 1.00 1.00 H new ATOM 0 HG13 VAL A 111 -12.801 -2.584 -3.797 1.00 1.00 H new ATOM 0 HG21 VAL A 111 -13.742 0.331 -3.307 1.00 1.00 H new ATOM 0 HG22 VAL A 111 -12.119 -0.246 -2.858 1.00 1.00 H new ATOM 0 HG23 VAL A 111 -12.298 1.168 -3.924 1.00 1.00 H new ATOM 576 N GLY A 112 -10.134 -3.003 -5.836 1.00 1.00 N ATOM 577 CA GLY A 112 -9.869 -4.253 -6.530 1.00 1.00 C ATOM 578 C GLY A 112 -8.464 -4.256 -7.134 1.00 1.00 C ATOM 579 O GLY A 112 -8.000 -5.281 -7.632 1.00 1.00 O ATOM 0 H GLY A 112 -9.506 -2.806 -5.057 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -9.973 -5.087 -5.836 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -10.608 -4.400 -7.318 1.00 1.00 H new ATOM 583 N ASP A 113 -7.823 -3.098 -7.070 1.00 1.00 N ATOM 584 CA ASP A 113 -6.480 -2.955 -7.606 1.00 1.00 C ATOM 585 C ASP A 113 -5.463 -3.197 -6.489 1.00 1.00 C ATOM 586 O ASP A 113 -5.623 -2.694 -5.378 1.00 1.00 O ATOM 587 CB ASP A 113 -6.252 -1.544 -8.154 1.00 1.00 C ATOM 588 CG ASP A 113 -6.382 -1.412 -9.672 1.00 1.00 C ATOM 589 OD1 ASP A 113 -7.424 -1.745 -10.256 1.00 1.00 O ATOM 590 OD2 ASP A 113 -5.341 -0.937 -10.269 1.00 1.00 O ATOM 0 H ASP A 113 -8.209 -2.250 -6.655 1.00 1.00 H new ATOM 0 HA ASP A 113 -6.360 -3.679 -8.412 1.00 1.00 H new ATOM 0 HB2 ASP A 113 -6.965 -0.868 -7.683 1.00 1.00 H new ATOM 0 HB3 ASP A 113 -5.256 -1.212 -7.859 1.00 1.00 H new ATOM 595 N THR A 114 -4.438 -3.969 -6.823 1.00 1.00 N ATOM 596 CA THR A 114 -3.395 -4.284 -5.862 1.00 1.00 C ATOM 597 C THR A 114 -2.748 -3.002 -5.337 1.00 1.00 C ATOM 598 O THR A 114 -2.641 -2.014 -6.062 1.00 1.00 O ATOM 599 CB THR A 114 -2.403 -5.234 -6.536 1.00 1.00 C ATOM 600 OG1 THR A 114 -3.192 -6.364 -6.895 1.00 1.00 O ATOM 601 CG2 THR A 114 -1.372 -5.796 -5.556 1.00 1.00 C ATOM 0 H THR A 114 -4.308 -4.385 -7.745 1.00 1.00 H new ATOM 0 HA THR A 114 -3.804 -4.786 -4.985 1.00 1.00 H new ATOM 0 HB THR A 114 -1.890 -4.709 -7.342 1.00 1.00 H new ATOM 0 HG1 THR A 114 -2.627 -7.030 -7.340 1.00 1.00 H new ATOM 0 HG21 THR A 114 -0.693 -6.464 -6.086 1.00 1.00 H new ATOM 0 HG22 THR A 114 -0.805 -4.976 -5.115 1.00 1.00 H new ATOM 0 HG23 THR A 114 -1.883 -6.349 -4.768 1.00 1.00 H new ATOM 609 N LEU A 115 -2.332 -3.059 -4.079 1.00 1.00 N ATOM 610 CA LEU A 115 -1.698 -1.913 -3.449 1.00 1.00 C ATOM 611 C LEU A 115 -0.242 -2.255 -3.128 1.00 1.00 C ATOM 612 O LEU A 115 0.638 -1.401 -3.234 1.00 1.00 O ATOM 613 CB LEU A 115 -2.505 -1.457 -2.232 1.00 1.00 C ATOM 614 CG LEU A 115 -3.422 -0.251 -2.450 1.00 1.00 C ATOM 615 CD1 LEU A 115 -4.136 0.135 -1.152 1.00 1.00 C ATOM 616 CD2 LEU A 115 -2.649 0.925 -3.050 1.00 1.00 C ATOM 0 H LEU A 115 -2.422 -3.880 -3.480 1.00 1.00 H new ATOM 0 HA LEU A 115 -1.684 -1.062 -4.130 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -3.113 -2.294 -1.890 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -1.809 -1.219 -1.428 1.00 1.00 H new ATOM 0 HG LEU A 115 -4.190 -0.532 -3.170 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -4.781 0.994 -1.333 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -4.738 -0.704 -0.805 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -3.397 0.390 -0.392 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -3.324 1.768 -3.195 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -1.845 1.215 -2.373 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -2.226 0.630 -4.010 1.00 1.00 H new ATOM 627 N CYS A 116 -0.031 -3.505 -2.742 1.00 1.00 N ATOM 628 CA CYS A 116 1.303 -3.969 -2.405 1.00 1.00 C ATOM 629 C CYS A 116 1.192 -5.395 -1.861 1.00 1.00 C ATOM 630 O CYS A 116 0.116 -5.992 -1.888 1.00 1.00 O ATOM 631 CB CYS A 116 1.995 -3.032 -1.413 1.00 1.00 C ATOM 632 SG CYS A 116 0.781 -2.404 -0.196 1.00 1.00 S ATOM 0 H CYS A 116 -0.762 -4.211 -2.655 1.00 1.00 H new ATOM 0 HA CYS A 116 1.927 -3.969 -3.299 1.00 1.00 H new ATOM 0 HB2 CYS A 116 2.797 -3.561 -0.899 1.00 1.00 H new ATOM 0 HB3 CYS A 116 2.453 -2.199 -1.946 1.00 1.00 H new ATOM 0 HG CYS A 116 1.400 -2.050 0.891 1.00 1.00 H new ATOM 637 N ILE A 117 2.319 -5.901 -1.380 1.00 1.00 N ATOM 638 CA ILE A 117 2.361 -7.245 -0.831 1.00 1.00 C ATOM 639 C ILE A 117 2.973 -7.200 0.571 1.00 1.00 C ATOM 640 O ILE A 117 3.635 -6.228 0.932 1.00 1.00 O ATOM 641 CB ILE A 117 3.088 -8.192 -1.788 1.00 1.00 C ATOM 642 CG1 ILE A 117 2.540 -8.061 -3.211 1.00 1.00 C ATOM 643 CG2 ILE A 117 3.029 -9.634 -1.282 1.00 1.00 C ATOM 644 CD1 ILE A 117 2.904 -9.284 -4.054 1.00 1.00 C ATOM 0 H ILE A 117 3.209 -5.404 -1.359 1.00 1.00 H new ATOM 0 HA ILE A 117 1.353 -7.645 -0.727 1.00 1.00 H new ATOM 0 HB ILE A 117 4.139 -7.905 -1.820 1.00 1.00 H new ATOM 0 HG12 ILE A 117 1.456 -7.947 -3.178 1.00 1.00 H new ATOM 0 HG13 ILE A 117 2.941 -7.161 -3.677 1.00 1.00 H new ATOM 0 HG21 ILE A 117 3.553 -10.286 -1.980 1.00 1.00 H new ATOM 0 HG22 ILE A 117 3.503 -9.696 -0.302 1.00 1.00 H new ATOM 0 HG23 ILE A 117 1.989 -9.949 -1.202 1.00 1.00 H new ATOM 0 HD11 ILE A 117 2.502 -9.165 -5.060 1.00 1.00 H new ATOM 0 HD12 ILE A 117 3.988 -9.381 -4.105 1.00 1.00 H new ATOM 0 HD13 ILE A 117 2.481 -10.179 -3.598 1.00 1.00 H new ATOM 655 N VAL A 118 2.728 -8.262 1.324 1.00 1.00 N ATOM 656 CA VAL A 118 3.246 -8.355 2.677 1.00 1.00 C ATOM 657 C VAL A 118 3.575 -9.816 2.994 1.00 1.00 C ATOM 658 O VAL A 118 2.739 -10.699 2.807 1.00 1.00 O ATOM 659 CB VAL A 118 2.250 -7.740 3.663 1.00 1.00 C ATOM 660 CG1 VAL A 118 2.429 -8.330 5.064 1.00 1.00 C ATOM 661 CG2 VAL A 118 2.375 -6.216 3.690 1.00 1.00 C ATOM 0 H VAL A 118 2.177 -9.066 1.022 1.00 1.00 H new ATOM 0 HA VAL A 118 4.170 -7.785 2.771 1.00 1.00 H new ATOM 0 HB VAL A 118 1.245 -7.988 3.321 1.00 1.00 H new ATOM 0 HG11 VAL A 118 1.709 -7.876 5.745 1.00 1.00 H new ATOM 0 HG12 VAL A 118 2.266 -9.407 5.029 1.00 1.00 H new ATOM 0 HG13 VAL A 118 3.440 -8.128 5.417 1.00 1.00 H new ATOM 0 HG21 VAL A 118 1.656 -5.804 4.399 1.00 1.00 H new ATOM 0 HG22 VAL A 118 3.384 -5.939 3.995 1.00 1.00 H new ATOM 0 HG23 VAL A 118 2.174 -5.817 2.696 1.00 1.00 H new ATOM 671 N GLU A 119 4.795 -10.025 3.468 1.00 1.00 N ATOM 672 CA GLU A 119 5.244 -11.363 3.811 1.00 1.00 C ATOM 673 C GLU A 119 4.792 -11.727 5.227 1.00 1.00 C ATOM 674 O GLU A 119 4.955 -10.939 6.158 1.00 1.00 O ATOM 675 CB GLU A 119 6.763 -11.484 3.673 1.00 1.00 C ATOM 676 CG GLU A 119 7.154 -12.839 3.082 1.00 1.00 C ATOM 677 CD GLU A 119 8.495 -12.753 2.350 1.00 1.00 C ATOM 678 OE1 GLU A 119 8.521 -12.629 1.117 1.00 1.00 O ATOM 679 OE2 GLU A 119 9.535 -12.815 3.110 1.00 1.00 O ATOM 0 H GLU A 119 5.486 -9.290 3.622 1.00 1.00 H new ATOM 0 HA GLU A 119 4.791 -12.067 3.113 1.00 1.00 H new ATOM 0 HB2 GLU A 119 7.139 -10.683 3.036 1.00 1.00 H new ATOM 0 HB3 GLU A 119 7.231 -11.360 4.649 1.00 1.00 H new ATOM 0 HG2 GLU A 119 7.217 -13.582 3.877 1.00 1.00 H new ATOM 0 HG3 GLU A 119 6.380 -13.176 2.392 1.00 1.00 H new ATOM 685 N ALA A 120 4.233 -12.923 5.346 1.00 1.00 N ATOM 686 CA ALA A 120 3.755 -13.401 6.633 1.00 1.00 C ATOM 687 C ALA A 120 3.598 -14.922 6.580 1.00 1.00 C ATOM 688 O ALA A 120 3.350 -15.488 5.515 1.00 1.00 O ATOM 689 CB ALA A 120 2.448 -12.691 6.989 1.00 1.00 C ATOM 0 H ALA A 120 4.100 -13.575 4.573 1.00 1.00 H new ATOM 0 HA ALA A 120 4.474 -13.171 7.419 1.00 1.00 H new ATOM 0 HB1 ALA A 120 2.090 -13.050 7.954 1.00 1.00 H new ATOM 0 HB2 ALA A 120 2.621 -11.616 7.043 1.00 1.00 H new ATOM 0 HB3 ALA A 120 1.700 -12.900 6.224 1.00 1.00 H new ATOM 695 N MET A 121 3.748 -15.542 7.742 1.00 1.00 N ATOM 696 CA MET A 121 3.625 -16.986 7.841 1.00 1.00 C ATOM 697 C MET A 121 4.434 -17.682 6.744 1.00 1.00 C ATOM 698 O MET A 121 3.959 -18.635 6.127 1.00 1.00 O ATOM 699 CB MET A 121 2.153 -17.383 7.719 1.00 1.00 C ATOM 700 CG MET A 121 1.374 -16.990 8.976 1.00 1.00 C ATOM 701 SD MET A 121 1.078 -18.432 9.987 1.00 1.00 S ATOM 702 CE MET A 121 -0.108 -19.289 8.964 1.00 1.00 C ATOM 0 H MET A 121 3.954 -15.070 8.623 1.00 1.00 H new ATOM 0 HA MET A 121 4.016 -17.299 8.809 1.00 1.00 H new ATOM 0 HB2 MET A 121 1.713 -16.898 6.848 1.00 1.00 H new ATOM 0 HB3 MET A 121 2.075 -18.458 7.559 1.00 1.00 H new ATOM 0 HG2 MET A 121 1.934 -16.247 9.543 1.00 1.00 H new ATOM 0 HG3 MET A 121 0.426 -16.530 8.697 1.00 1.00 H new ATOM 0 HE1 MET A 121 -0.767 -19.886 9.594 1.00 1.00 H new ATOM 0 HE2 MET A 121 -0.699 -18.563 8.406 1.00 1.00 H new ATOM 0 HE3 MET A 121 0.417 -19.942 8.267 1.00 1.00 H new ATOM 710 N LYS A 122 5.642 -17.179 6.533 1.00 1.00 N ATOM 711 CA LYS A 122 6.520 -17.740 5.521 1.00 1.00 C ATOM 712 C LYS A 122 5.749 -17.888 4.208 1.00 1.00 C ATOM 713 O LYS A 122 5.840 -18.920 3.545 1.00 1.00 O ATOM 714 CB LYS A 122 7.145 -19.045 6.018 1.00 1.00 C ATOM 715 CG LYS A 122 6.082 -20.131 6.189 1.00 1.00 C ATOM 716 CD LYS A 122 6.726 -21.515 6.302 1.00 1.00 C ATOM 717 CE LYS A 122 5.929 -22.558 5.515 1.00 1.00 C ATOM 718 NZ LYS A 122 4.613 -22.791 6.151 1.00 1.00 N ATOM 0 H LYS A 122 6.033 -16.389 7.046 1.00 1.00 H new ATOM 0 HA LYS A 122 7.355 -17.067 5.326 1.00 1.00 H new ATOM 0 HB2 LYS A 122 7.903 -19.382 5.311 1.00 1.00 H new ATOM 0 HB3 LYS A 122 7.650 -18.872 6.969 1.00 1.00 H new ATOM 0 HG2 LYS A 122 5.489 -19.928 7.081 1.00 1.00 H new ATOM 0 HG3 LYS A 122 5.398 -20.112 5.341 1.00 1.00 H new ATOM 0 HD2 LYS A 122 7.749 -21.475 5.927 1.00 1.00 H new ATOM 0 HD3 LYS A 122 6.781 -21.810 7.350 1.00 1.00 H new ATOM 0 HE2 LYS A 122 5.789 -22.219 4.489 1.00 1.00 H new ATOM 0 HE3 LYS A 122 6.488 -23.493 5.468 1.00 1.00 H new ATOM 0 HZ1 LYS A 122 4.105 -23.538 5.635 1.00 1.00 H new ATOM 0 HZ2 LYS A 122 4.752 -23.086 7.139 1.00 1.00 H new ATOM 0 HZ3 LYS A 122 4.056 -21.913 6.127 1.00 1.00 H new ATOM 727 N MET A 123 5.008 -16.842 3.872 1.00 1.00 N ATOM 728 CA MET A 123 4.222 -16.844 2.650 1.00 1.00 C ATOM 729 C MET A 123 3.802 -15.423 2.267 1.00 1.00 C ATOM 730 O MET A 123 3.459 -14.619 3.133 1.00 1.00 O ATOM 731 CB MET A 123 2.976 -17.710 2.846 1.00 1.00 C ATOM 732 CG MET A 123 3.126 -19.055 2.130 1.00 1.00 C ATOM 733 SD MET A 123 3.385 -18.792 0.385 1.00 1.00 S ATOM 734 CE MET A 123 4.996 -19.538 0.195 1.00 1.00 C ATOM 0 H MET A 123 4.935 -15.988 4.425 1.00 1.00 H new ATOM 0 HA MET A 123 4.835 -17.251 1.846 1.00 1.00 H new ATOM 0 HB2 MET A 123 2.808 -17.877 3.910 1.00 1.00 H new ATOM 0 HB3 MET A 123 2.100 -17.186 2.464 1.00 1.00 H new ATOM 0 HG2 MET A 123 3.965 -19.609 2.551 1.00 1.00 H new ATOM 0 HG3 MET A 123 2.234 -19.661 2.286 1.00 1.00 H new ATOM 0 HE1 MET A 123 5.442 -19.206 -0.742 1.00 1.00 H new ATOM 0 HE2 MET A 123 5.635 -19.241 1.027 1.00 1.00 H new ATOM 0 HE3 MET A 123 4.895 -20.623 0.184 1.00 1.00 H new ATOM 742 N MET A 124 3.843 -15.159 0.970 1.00 1.00 N ATOM 743 CA MET A 124 3.470 -13.849 0.462 1.00 1.00 C ATOM 744 C MET A 124 1.971 -13.597 0.639 1.00 1.00 C ATOM 745 O MET A 124 1.163 -14.512 0.487 1.00 1.00 O ATOM 746 CB MET A 124 3.832 -13.755 -1.023 1.00 1.00 C ATOM 747 CG MET A 124 2.793 -14.475 -1.885 1.00 1.00 C ATOM 748 SD MET A 124 2.790 -16.220 -1.510 1.00 1.00 S ATOM 749 CE MET A 124 1.483 -16.768 -2.594 1.00 1.00 C ATOM 0 H MET A 124 4.128 -15.829 0.256 1.00 1.00 H new ATOM 0 HA MET A 124 4.015 -13.093 1.027 1.00 1.00 H new ATOM 0 HB2 MET A 124 3.895 -12.708 -1.321 1.00 1.00 H new ATOM 0 HB3 MET A 124 4.816 -14.193 -1.190 1.00 1.00 H new ATOM 0 HG2 MET A 124 1.804 -14.054 -1.704 1.00 1.00 H new ATOM 0 HG3 MET A 124 3.016 -14.322 -2.941 1.00 1.00 H new ATOM 0 HE1 MET A 124 1.348 -17.844 -2.486 1.00 1.00 H new ATOM 0 HE2 MET A 124 0.556 -16.258 -2.333 1.00 1.00 H new ATOM 0 HE3 MET A 124 1.746 -16.538 -3.626 1.00 1.00 H new ATOM 757 N ASN A 125 1.647 -12.354 0.959 1.00 1.00 N ATOM 758 CA ASN A 125 0.260 -11.970 1.159 1.00 1.00 C ATOM 759 C ASN A 125 0.004 -10.622 0.482 1.00 1.00 C ATOM 760 O ASN A 125 0.393 -9.579 1.004 1.00 1.00 O ATOM 761 CB ASN A 125 -0.062 -11.821 2.648 1.00 1.00 C ATOM 762 CG ASN A 125 0.117 -13.150 3.383 1.00 1.00 C ATOM 763 OD1 ASN A 125 1.369 -13.397 3.757 1.00 1.00 O flip ATOM 764 ND2 ASN A 125 -0.821 -13.901 3.598 1.00 1.00 N flip ATOM 0 H ASN A 125 2.321 -11.599 1.085 1.00 1.00 H new ATOM 0 HA ASN A 125 -0.370 -12.750 0.730 1.00 1.00 H new ATOM 0 HB2 ASN A 125 0.588 -11.066 3.091 1.00 1.00 H new ATOM 0 HB3 ASN A 125 -1.087 -11.470 2.769 1.00 1.00 H new ATOM 0 HD21 ASN A 125 -1.758 -13.650 3.283 1.00 1.00 H new ATOM 0 HD22 ASN A 125 -0.668 -14.780 4.093 1.00 1.00 H new ATOM 770 N GLN A 126 -0.647 -10.688 -0.669 1.00 1.00 N ATOM 771 CA GLN A 126 -0.958 -9.486 -1.423 1.00 1.00 C ATOM 772 C GLN A 126 -2.014 -8.657 -0.688 1.00 1.00 C ATOM 773 O GLN A 126 -2.764 -9.186 0.131 1.00 1.00 O ATOM 774 CB GLN A 126 -1.422 -9.831 -2.839 1.00 1.00 C ATOM 775 CG GLN A 126 -0.236 -10.215 -3.726 1.00 1.00 C ATOM 776 CD GLN A 126 -0.654 -11.228 -4.794 1.00 1.00 C ATOM 777 OE1 GLN A 126 -0.630 -12.430 -4.588 1.00 1.00 O ATOM 778 NE2 GLN A 126 -1.038 -10.677 -5.942 1.00 1.00 N ATOM 0 H GLN A 126 -0.968 -11.556 -1.098 1.00 1.00 H new ATOM 0 HA GLN A 126 -0.050 -8.890 -1.509 1.00 1.00 H new ATOM 0 HB2 GLN A 126 -2.134 -10.655 -2.801 1.00 1.00 H new ATOM 0 HB3 GLN A 126 -1.944 -8.978 -3.273 1.00 1.00 H new ATOM 0 HG2 GLN A 126 0.168 -9.323 -4.204 1.00 1.00 H new ATOM 0 HG3 GLN A 126 0.560 -10.636 -3.112 1.00 1.00 H new ATOM 0 HE21 GLN A 126 -1.034 -9.662 -6.047 1.00 1.00 H new ATOM 0 HE22 GLN A 126 -1.337 -11.269 -6.717 1.00 1.00 H new ATOM 785 N ILE A 127 -2.038 -7.371 -1.007 1.00 1.00 N ATOM 786 CA ILE A 127 -2.988 -6.464 -0.386 1.00 1.00 C ATOM 787 C ILE A 127 -3.775 -5.733 -1.476 1.00 1.00 C ATOM 788 O ILE A 127 -3.199 -4.989 -2.269 1.00 1.00 O ATOM 789 CB ILE A 127 -2.276 -5.527 0.592 1.00 1.00 C ATOM 790 CG1 ILE A 127 -1.125 -6.246 1.299 1.00 1.00 C ATOM 791 CG2 ILE A 127 -3.266 -4.916 1.584 1.00 1.00 C ATOM 792 CD1 ILE A 127 -0.716 -5.503 2.573 1.00 1.00 C ATOM 0 H ILE A 127 -1.415 -6.936 -1.687 1.00 1.00 H new ATOM 0 HA ILE A 127 -3.710 -7.020 0.212 1.00 1.00 H new ATOM 0 HB ILE A 127 -1.841 -4.705 0.024 1.00 1.00 H new ATOM 0 HG12 ILE A 127 -1.425 -7.264 1.548 1.00 1.00 H new ATOM 0 HG13 ILE A 127 -0.270 -6.321 0.627 1.00 1.00 H new ATOM 0 HG21 ILE A 127 -2.734 -4.254 2.268 1.00 1.00 H new ATOM 0 HG22 ILE A 127 -4.020 -4.347 1.041 1.00 1.00 H new ATOM 0 HG23 ILE A 127 -3.750 -5.711 2.151 1.00 1.00 H new ATOM 0 HD11 ILE A 127 0.104 -6.034 3.057 1.00 1.00 H new ATOM 0 HD12 ILE A 127 -0.394 -4.493 2.318 1.00 1.00 H new ATOM 0 HD13 ILE A 127 -1.566 -5.451 3.253 1.00 1.00 H new ATOM 803 N GLU A 128 -5.079 -5.969 -1.481 1.00 1.00 N ATOM 804 CA GLU A 128 -5.949 -5.342 -2.461 1.00 1.00 C ATOM 805 C GLU A 128 -6.487 -4.016 -1.920 1.00 1.00 C ATOM 806 O GLU A 128 -7.011 -3.961 -0.809 1.00 1.00 O ATOM 807 CB GLU A 128 -7.094 -6.278 -2.855 1.00 1.00 C ATOM 808 CG GLU A 128 -7.684 -5.881 -4.210 1.00 1.00 C ATOM 809 CD GLU A 128 -8.662 -6.944 -4.714 1.00 1.00 C ATOM 810 OE1 GLU A 128 -9.744 -7.117 -4.131 1.00 1.00 O ATOM 811 OE2 GLU A 128 -8.267 -7.601 -5.751 1.00 1.00 O ATOM 0 H GLU A 128 -5.554 -6.586 -0.822 1.00 1.00 H new ATOM 0 HA GLU A 128 -5.366 -5.137 -3.359 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -6.731 -7.305 -2.899 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -7.872 -6.248 -2.092 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -8.196 -4.923 -4.121 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.881 -5.747 -4.935 1.00 1.00 H new ATOM 817 N ALA A 129 -6.340 -2.979 -2.732 1.00 1.00 N ATOM 818 CA ALA A 129 -6.804 -1.656 -2.350 1.00 1.00 C ATOM 819 C ALA A 129 -8.154 -1.780 -1.641 1.00 1.00 C ATOM 820 O ALA A 129 -9.047 -2.481 -2.116 1.00 1.00 O ATOM 821 CB ALA A 129 -6.877 -0.763 -3.589 1.00 1.00 C ATOM 0 H ALA A 129 -5.906 -3.029 -3.654 1.00 1.00 H new ATOM 0 HA ALA A 129 -6.106 -1.191 -1.654 1.00 1.00 H new ATOM 0 HB1 ALA A 129 -7.225 0.229 -3.302 1.00 1.00 H new ATOM 0 HB2 ALA A 129 -5.888 -0.684 -4.040 1.00 1.00 H new ATOM 0 HB3 ALA A 129 -7.570 -1.197 -4.310 1.00 1.00 H new ATOM 827 N ASP A 130 -8.261 -1.089 -0.516 1.00 1.00 N ATOM 828 CA ASP A 130 -9.488 -1.113 0.263 1.00 1.00 C ATOM 829 C ASP A 130 -10.070 0.301 0.333 1.00 1.00 C ATOM 830 O ASP A 130 -10.945 0.576 1.153 1.00 1.00 O ATOM 831 CB ASP A 130 -9.222 -1.585 1.694 1.00 1.00 C ATOM 832 CG ASP A 130 -7.860 -1.185 2.265 1.00 1.00 C ATOM 833 OD1 ASP A 130 -7.396 -0.051 2.074 1.00 1.00 O ATOM 834 OD2 ASP A 130 -7.260 -2.105 2.941 1.00 1.00 O ATOM 0 H ASP A 130 -7.519 -0.509 -0.125 1.00 1.00 H new ATOM 0 HA ASP A 130 -10.182 -1.800 -0.221 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -10.002 -1.187 2.343 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -9.307 -2.671 1.724 1.00 1.00 H new ATOM 839 N LYS A 131 -9.562 1.159 -0.539 1.00 1.00 N ATOM 840 CA LYS A 131 -10.021 2.536 -0.587 1.00 1.00 C ATOM 841 C LYS A 131 -9.366 3.247 -1.774 1.00 1.00 C ATOM 842 O LYS A 131 -8.305 3.853 -1.631 1.00 1.00 O ATOM 843 CB LYS A 131 -9.778 3.229 0.755 1.00 1.00 C ATOM 844 CG LYS A 131 -10.645 4.482 0.890 1.00 1.00 C ATOM 845 CD LYS A 131 -9.792 5.707 1.226 1.00 1.00 C ATOM 846 CE LYS A 131 -10.577 7.001 1.002 1.00 1.00 C ATOM 847 NZ LYS A 131 -10.016 7.756 -0.141 1.00 1.00 N ATOM 0 H LYS A 131 -8.837 0.927 -1.218 1.00 1.00 H new ATOM 0 HA LYS A 131 -11.098 2.573 -0.748 1.00 1.00 H new ATOM 0 HB2 LYS A 131 -10.000 2.540 1.570 1.00 1.00 H new ATOM 0 HB3 LYS A 131 -8.726 3.499 0.843 1.00 1.00 H new ATOM 0 HG2 LYS A 131 -11.186 4.656 -0.040 1.00 1.00 H new ATOM 0 HG3 LYS A 131 -11.391 4.330 1.670 1.00 1.00 H new ATOM 0 HD2 LYS A 131 -9.463 5.652 2.264 1.00 1.00 H new ATOM 0 HD3 LYS A 131 -8.895 5.710 0.607 1.00 1.00 H new ATOM 0 HE2 LYS A 131 -11.625 6.769 0.813 1.00 1.00 H new ATOM 0 HE3 LYS A 131 -10.543 7.614 1.902 1.00 1.00 H new ATOM 0 HZ1 LYS A 131 -10.560 8.631 -0.279 1.00 1.00 H new ATOM 0 HZ2 LYS A 131 -9.022 7.993 0.054 1.00 1.00 H new ATOM 0 HZ3 LYS A 131 -10.071 7.175 -1.002 1.00 1.00 H new ATOM 856 N SER A 132 -10.025 3.147 -2.919 1.00 1.00 N ATOM 857 CA SER A 132 -9.520 3.773 -4.130 1.00 1.00 C ATOM 858 C SER A 132 -8.920 5.141 -3.801 1.00 1.00 C ATOM 859 O SER A 132 -9.492 5.902 -3.021 1.00 1.00 O ATOM 860 CB SER A 132 -10.625 3.915 -5.178 1.00 1.00 C ATOM 861 OG SER A 132 -11.348 2.702 -5.361 1.00 1.00 O ATOM 0 H SER A 132 -10.904 2.642 -3.034 1.00 1.00 H new ATOM 0 HA SER A 132 -8.742 3.134 -4.547 1.00 1.00 H new ATOM 0 HB2 SER A 132 -11.313 4.704 -4.875 1.00 1.00 H new ATOM 0 HB3 SER A 132 -10.186 4.222 -6.127 1.00 1.00 H new ATOM 0 HG SER A 132 -12.293 2.849 -5.147 1.00 1.00 H new ATOM 866 N GLY A 133 -7.777 5.413 -4.412 1.00 1.00 N ATOM 867 CA GLY A 133 -7.094 6.677 -4.193 1.00 1.00 C ATOM 868 C GLY A 133 -5.799 6.748 -5.007 1.00 1.00 C ATOM 869 O GLY A 133 -5.509 5.851 -5.798 1.00 1.00 O ATOM 0 H GLY A 133 -7.306 4.780 -5.059 1.00 1.00 H new ATOM 0 HA2 GLY A 133 -7.749 7.502 -4.472 1.00 1.00 H new ATOM 0 HA3 GLY A 133 -6.869 6.794 -3.133 1.00 1.00 H new ATOM 873 N THR A 134 -5.056 7.822 -4.783 1.00 1.00 N ATOM 874 CA THR A 134 -3.799 8.022 -5.485 1.00 1.00 C ATOM 875 C THR A 134 -2.626 7.968 -4.504 1.00 1.00 C ATOM 876 O THR A 134 -2.826 7.983 -3.291 1.00 1.00 O ATOM 877 CB THR A 134 -3.892 9.343 -6.251 1.00 1.00 C ATOM 878 OG1 THR A 134 -4.275 8.955 -7.568 1.00 1.00 O ATOM 879 CG2 THR A 134 -2.525 10.006 -6.441 1.00 1.00 C ATOM 0 H THR A 134 -5.300 8.563 -4.126 1.00 1.00 H new ATOM 0 HA THR A 134 -3.615 7.224 -6.205 1.00 1.00 H new ATOM 0 HB THR A 134 -4.556 10.025 -5.720 1.00 1.00 H new ATOM 0 HG1 THR A 134 -4.360 9.752 -8.132 1.00 1.00 H new ATOM 0 HG21 THR A 134 -2.647 10.940 -6.990 1.00 1.00 H new ATOM 0 HG22 THR A 134 -2.082 10.213 -5.467 1.00 1.00 H new ATOM 0 HG23 THR A 134 -1.871 9.338 -7.002 1.00 1.00 H new ATOM 887 N VAL A 135 -1.429 7.906 -5.068 1.00 1.00 N ATOM 888 CA VAL A 135 -0.224 7.850 -4.259 1.00 1.00 C ATOM 889 C VAL A 135 -0.154 9.092 -3.367 1.00 1.00 C ATOM 890 O VAL A 135 -0.777 10.109 -3.665 1.00 1.00 O ATOM 891 CB VAL A 135 1.004 7.691 -5.158 1.00 1.00 C ATOM 892 CG1 VAL A 135 1.231 8.946 -6.003 1.00 1.00 C ATOM 893 CG2 VAL A 135 2.248 7.353 -4.334 1.00 1.00 C ATOM 0 H VAL A 135 -1.268 7.893 -6.075 1.00 1.00 H new ATOM 0 HA VAL A 135 -0.246 6.979 -3.603 1.00 1.00 H new ATOM 0 HB VAL A 135 0.816 6.859 -5.837 1.00 1.00 H new ATOM 0 HG11 VAL A 135 2.110 8.807 -6.633 1.00 1.00 H new ATOM 0 HG12 VAL A 135 0.359 9.124 -6.632 1.00 1.00 H new ATOM 0 HG13 VAL A 135 1.387 9.803 -5.347 1.00 1.00 H new ATOM 0 HG21 VAL A 135 3.106 7.246 -4.998 1.00 1.00 H new ATOM 0 HG22 VAL A 135 2.440 8.154 -3.620 1.00 1.00 H new ATOM 0 HG23 VAL A 135 2.086 6.419 -3.797 1.00 1.00 H new ATOM 903 N LYS A 136 0.609 8.966 -2.290 1.00 1.00 N ATOM 904 CA LYS A 136 0.767 10.065 -1.353 1.00 1.00 C ATOM 905 C LYS A 136 2.189 10.049 -0.791 1.00 1.00 C ATOM 906 O LYS A 136 2.852 11.084 -0.738 1.00 1.00 O ATOM 907 CB LYS A 136 -0.320 10.014 -0.279 1.00 1.00 C ATOM 908 CG LYS A 136 -0.500 11.381 0.386 1.00 1.00 C ATOM 909 CD LYS A 136 -1.238 12.348 -0.540 1.00 1.00 C ATOM 910 CE LYS A 136 -0.884 13.800 -0.212 1.00 1.00 C ATOM 911 NZ LYS A 136 -1.906 14.719 -0.759 1.00 1.00 N ATOM 0 H LYS A 136 1.124 8.120 -2.046 1.00 1.00 H new ATOM 0 HA LYS A 136 0.635 11.021 -1.861 1.00 1.00 H new ATOM 0 HB2 LYS A 136 -1.262 9.696 -0.725 1.00 1.00 H new ATOM 0 HB3 LYS A 136 -0.057 9.271 0.474 1.00 1.00 H new ATOM 0 HG2 LYS A 136 -1.057 11.266 1.316 1.00 1.00 H new ATOM 0 HG3 LYS A 136 0.475 11.794 0.647 1.00 1.00 H new ATOM 0 HD2 LYS A 136 -0.980 12.132 -1.577 1.00 1.00 H new ATOM 0 HD3 LYS A 136 -2.314 12.201 -0.442 1.00 1.00 H new ATOM 0 HE2 LYS A 136 -0.812 13.928 0.868 1.00 1.00 H new ATOM 0 HE3 LYS A 136 0.093 14.045 -0.628 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 -1.650 15.700 -0.527 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 -1.955 14.609 -1.792 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 -2.832 14.495 -0.343 1.00 1.00 H new ATOM 920 N ALA A 137 2.618 8.862 -0.385 1.00 1.00 N ATOM 921 CA ALA A 137 3.949 8.698 0.172 1.00 1.00 C ATOM 922 C ALA A 137 4.084 7.288 0.752 1.00 1.00 C ATOM 923 O ALA A 137 3.208 6.826 1.481 1.00 1.00 O ATOM 924 CB ALA A 137 4.204 9.785 1.218 1.00 1.00 C ATOM 0 H ALA A 137 2.066 8.005 -0.431 1.00 1.00 H new ATOM 0 HA ALA A 137 4.706 8.810 -0.605 1.00 1.00 H new ATOM 0 HB1 ALA A 137 5.203 9.661 1.635 1.00 1.00 H new ATOM 0 HB2 ALA A 137 4.126 10.766 0.750 1.00 1.00 H new ATOM 0 HB3 ALA A 137 3.465 9.703 2.015 1.00 1.00 H new ATOM 930 N ILE A 138 5.189 6.644 0.405 1.00 1.00 N ATOM 931 CA ILE A 138 5.450 5.296 0.882 1.00 1.00 C ATOM 932 C ILE A 138 6.511 5.346 1.984 1.00 1.00 C ATOM 933 O ILE A 138 7.578 5.928 1.797 1.00 1.00 O ATOM 934 CB ILE A 138 5.819 4.377 -0.285 1.00 1.00 C ATOM 935 CG1 ILE A 138 5.123 4.821 -1.573 1.00 1.00 C ATOM 936 CG2 ILE A 138 5.520 2.915 0.053 1.00 1.00 C ATOM 937 CD1 ILE A 138 5.103 3.690 -2.604 1.00 1.00 C ATOM 0 H ILE A 138 5.913 7.030 -0.200 1.00 1.00 H new ATOM 0 HA ILE A 138 4.550 4.867 1.324 1.00 1.00 H new ATOM 0 HB ILE A 138 6.893 4.455 -0.455 1.00 1.00 H new ATOM 0 HG12 ILE A 138 4.103 5.133 -1.350 1.00 1.00 H new ATOM 0 HG13 ILE A 138 5.638 5.687 -1.988 1.00 1.00 H new ATOM 0 HG21 ILE A 138 5.791 2.283 -0.793 1.00 1.00 H new ATOM 0 HG22 ILE A 138 6.098 2.618 0.928 1.00 1.00 H new ATOM 0 HG23 ILE A 138 4.457 2.801 0.265 1.00 1.00 H new ATOM 0 HD11 ILE A 138 4.603 4.032 -3.510 1.00 1.00 H new ATOM 0 HD12 ILE A 138 6.125 3.397 -2.843 1.00 1.00 H new ATOM 0 HD13 ILE A 138 4.567 2.834 -2.195 1.00 1.00 H new ATOM 948 N LEU A 139 6.179 4.727 3.108 1.00 1.00 N ATOM 949 CA LEU A 139 7.089 4.694 4.240 1.00 1.00 C ATOM 950 C LEU A 139 7.902 3.399 4.197 1.00 1.00 C ATOM 951 O LEU A 139 9.122 3.423 4.357 1.00 1.00 O ATOM 952 CB LEU A 139 6.323 4.896 5.550 1.00 1.00 C ATOM 953 CG LEU A 139 4.920 5.493 5.421 1.00 1.00 C ATOM 954 CD1 LEU A 139 4.254 5.629 6.792 1.00 1.00 C ATOM 955 CD2 LEU A 139 4.957 6.824 4.667 1.00 1.00 C ATOM 0 H LEU A 139 5.293 4.245 3.259 1.00 1.00 H new ATOM 0 HA LEU A 139 7.799 5.519 4.182 1.00 1.00 H new ATOM 0 HB2 LEU A 139 6.241 3.932 6.053 1.00 1.00 H new ATOM 0 HB3 LEU A 139 6.914 5.544 6.197 1.00 1.00 H new ATOM 0 HG LEU A 139 4.310 4.807 4.833 1.00 1.00 H new ATOM 0 HD11 LEU A 139 3.258 6.056 6.672 1.00 1.00 H new ATOM 0 HD12 LEU A 139 4.174 4.646 7.257 1.00 1.00 H new ATOM 0 HD13 LEU A 139 4.855 6.282 7.425 1.00 1.00 H new ATOM 0 HD21 LEU A 139 3.947 7.226 4.589 1.00 1.00 H new ATOM 0 HD22 LEU A 139 5.589 7.530 5.206 1.00 1.00 H new ATOM 0 HD23 LEU A 139 5.362 6.665 3.668 1.00 1.00 H new ATOM 966 N VAL A 140 7.195 2.301 3.979 1.00 1.00 N ATOM 967 CA VAL A 140 7.836 0.998 3.912 1.00 1.00 C ATOM 968 C VAL A 140 8.474 0.819 2.533 1.00 1.00 C ATOM 969 O VAL A 140 7.970 1.339 1.539 1.00 1.00 O ATOM 970 CB VAL A 140 6.827 -0.100 4.252 1.00 1.00 C ATOM 971 CG1 VAL A 140 5.717 -0.168 3.201 1.00 1.00 C ATOM 972 CG2 VAL A 140 7.522 -1.455 4.405 1.00 1.00 C ATOM 0 H VAL A 140 6.184 2.286 3.846 1.00 1.00 H new ATOM 0 HA VAL A 140 8.634 0.926 4.651 1.00 1.00 H new ATOM 0 HB VAL A 140 6.368 0.150 5.208 1.00 1.00 H new ATOM 0 HG11 VAL A 140 5.013 -0.957 3.466 1.00 1.00 H new ATOM 0 HG12 VAL A 140 5.194 0.788 3.162 1.00 1.00 H new ATOM 0 HG13 VAL A 140 6.152 -0.383 2.225 1.00 1.00 H new ATOM 0 HG21 VAL A 140 6.782 -2.218 4.647 1.00 1.00 H new ATOM 0 HG22 VAL A 140 8.021 -1.716 3.471 1.00 1.00 H new ATOM 0 HG23 VAL A 140 8.259 -1.398 5.206 1.00 1.00 H new ATOM 982 N GLU A 141 9.574 0.081 2.516 1.00 1.00 N ATOM 983 CA GLU A 141 10.286 -0.174 1.276 1.00 1.00 C ATOM 984 C GLU A 141 9.962 -1.577 0.757 1.00 1.00 C ATOM 985 O GLU A 141 9.347 -2.376 1.460 1.00 1.00 O ATOM 986 CB GLU A 141 11.794 0.008 1.461 1.00 1.00 C ATOM 987 CG GLU A 141 12.398 0.800 0.301 1.00 1.00 C ATOM 988 CD GLU A 141 13.782 0.263 -0.068 1.00 1.00 C ATOM 989 OE1 GLU A 141 14.793 0.945 0.162 1.00 1.00 O ATOM 990 OE2 GLU A 141 13.786 -0.906 -0.612 1.00 1.00 O ATOM 0 H GLU A 141 9.990 -0.349 3.342 1.00 1.00 H new ATOM 0 HA GLU A 141 9.955 0.552 0.534 1.00 1.00 H new ATOM 0 HB2 GLU A 141 11.989 0.526 2.400 1.00 1.00 H new ATOM 0 HB3 GLU A 141 12.276 -0.967 1.530 1.00 1.00 H new ATOM 0 HG2 GLU A 141 11.739 0.743 -0.565 1.00 1.00 H new ATOM 0 HG3 GLU A 141 12.474 1.852 0.575 1.00 1.00 H new ATOM 996 N SER A 142 10.392 -1.832 -0.470 1.00 1.00 N ATOM 997 CA SER A 142 10.156 -3.124 -1.092 1.00 1.00 C ATOM 998 C SER A 142 11.136 -4.159 -0.536 1.00 1.00 C ATOM 999 O SER A 142 12.207 -4.372 -1.102 1.00 1.00 O ATOM 1000 CB SER A 142 10.284 -3.035 -2.614 1.00 1.00 C ATOM 1001 OG SER A 142 10.297 -4.322 -3.225 1.00 1.00 O ATOM 0 H SER A 142 10.902 -1.166 -1.050 1.00 1.00 H new ATOM 0 HA SER A 142 9.138 -3.435 -0.858 1.00 1.00 H new ATOM 0 HB2 SER A 142 9.454 -2.452 -3.014 1.00 1.00 H new ATOM 0 HB3 SER A 142 11.200 -2.503 -2.870 1.00 1.00 H new ATOM 0 HG SER A 142 10.378 -4.222 -4.196 1.00 1.00 H new ATOM 1006 N GLY A 143 10.733 -4.776 0.566 1.00 1.00 N ATOM 1007 CA GLY A 143 11.563 -5.784 1.205 1.00 1.00 C ATOM 1008 C GLY A 143 11.784 -5.454 2.683 1.00 1.00 C ATOM 1009 O GLY A 143 12.376 -6.245 3.416 1.00 1.00 O ATOM 0 H GLY A 143 9.843 -4.597 1.032 1.00 1.00 H new ATOM 0 HA2 GLY A 143 11.090 -6.762 1.114 1.00 1.00 H new ATOM 0 HA3 GLY A 143 12.524 -5.846 0.695 1.00 1.00 H new ATOM 1013 N GLN A 144 11.296 -4.288 3.076 1.00 1.00 N ATOM 1014 CA GLN A 144 11.433 -3.845 4.453 1.00 1.00 C ATOM 1015 C GLN A 144 10.394 -4.535 5.339 1.00 1.00 C ATOM 1016 O GLN A 144 9.310 -4.883 4.873 1.00 1.00 O ATOM 1017 CB GLN A 144 11.316 -2.323 4.554 1.00 1.00 C ATOM 1018 CG GLN A 144 12.597 -1.711 5.125 1.00 1.00 C ATOM 1019 CD GLN A 144 12.962 -0.420 4.390 1.00 1.00 C ATOM 1020 OE1 GLN A 144 13.740 -0.408 3.450 1.00 1.00 O ATOM 1021 NE2 GLN A 144 12.359 0.665 4.869 1.00 1.00 N ATOM 0 H GLN A 144 10.805 -3.636 2.465 1.00 1.00 H new ATOM 0 HA GLN A 144 12.426 -4.124 4.806 1.00 1.00 H new ATOM 0 HB2 GLN A 144 11.117 -1.904 3.568 1.00 1.00 H new ATOM 0 HB3 GLN A 144 10.469 -2.061 5.189 1.00 1.00 H new ATOM 0 HG2 GLN A 144 12.464 -1.504 6.187 1.00 1.00 H new ATOM 0 HG3 GLN A 144 13.415 -2.426 5.040 1.00 1.00 H new ATOM 0 HE21 GLN A 144 11.718 0.586 5.659 1.00 1.00 H new ATOM 0 HE22 GLN A 144 12.537 1.576 4.446 1.00 1.00 H new ATOM 1028 N PRO A 145 10.770 -4.715 6.632 1.00 1.00 N ATOM 1029 CA PRO A 145 9.882 -5.357 7.587 1.00 1.00 C ATOM 1030 C PRO A 145 8.756 -4.412 8.010 1.00 1.00 C ATOM 1031 O PRO A 145 8.882 -3.195 7.884 1.00 1.00 O ATOM 1032 CB PRO A 145 10.779 -5.768 8.744 1.00 1.00 C ATOM 1033 CG PRO A 145 12.043 -4.934 8.607 1.00 1.00 C ATOM 1034 CD PRO A 145 12.045 -4.315 7.220 1.00 1.00 C ATOM 0 HA PRO A 145 9.371 -6.224 7.169 1.00 1.00 H new ATOM 0 HB2 PRO A 145 10.291 -5.584 9.701 1.00 1.00 H new ATOM 0 HB3 PRO A 145 11.007 -6.833 8.702 1.00 1.00 H new ATOM 0 HG2 PRO A 145 12.073 -4.158 9.371 1.00 1.00 H new ATOM 0 HG3 PRO A 145 12.927 -5.555 8.749 1.00 1.00 H new ATOM 0 HD2 PRO A 145 12.134 -3.230 7.271 1.00 1.00 H new ATOM 0 HD3 PRO A 145 12.885 -4.676 6.627 1.00 1.00 H new ATOM 1039 N VAL A 146 7.681 -5.007 8.506 1.00 1.00 N ATOM 1040 CA VAL A 146 6.533 -4.234 8.948 1.00 1.00 C ATOM 1041 C VAL A 146 6.000 -4.823 10.255 1.00 1.00 C ATOM 1042 O VAL A 146 6.235 -5.992 10.555 1.00 1.00 O ATOM 1043 CB VAL A 146 5.478 -4.183 7.841 1.00 1.00 C ATOM 1044 CG1 VAL A 146 6.113 -3.829 6.494 1.00 1.00 C ATOM 1045 CG2 VAL A 146 4.709 -5.503 7.755 1.00 1.00 C ATOM 0 H VAL A 146 7.581 -6.017 8.612 1.00 1.00 H new ATOM 0 HA VAL A 146 6.822 -3.203 9.150 1.00 1.00 H new ATOM 0 HB VAL A 146 4.766 -3.397 8.093 1.00 1.00 H new ATOM 0 HG11 VAL A 146 5.341 -3.799 5.725 1.00 1.00 H new ATOM 0 HG12 VAL A 146 6.594 -2.853 6.564 1.00 1.00 H new ATOM 0 HG13 VAL A 146 6.857 -4.582 6.233 1.00 1.00 H new ATOM 0 HG21 VAL A 146 3.966 -5.440 6.960 1.00 1.00 H new ATOM 0 HG22 VAL A 146 5.403 -6.315 7.539 1.00 1.00 H new ATOM 0 HG23 VAL A 146 4.210 -5.696 8.705 1.00 1.00 H new ATOM 1055 N GLU A 147 5.291 -3.986 10.999 1.00 1.00 N ATOM 1056 CA GLU A 147 4.723 -4.409 12.267 1.00 1.00 C ATOM 1057 C GLU A 147 3.250 -4.003 12.350 1.00 1.00 C ATOM 1058 O GLU A 147 2.841 -3.011 11.750 1.00 1.00 O ATOM 1059 CB GLU A 147 5.517 -3.837 13.443 1.00 1.00 C ATOM 1060 CG GLU A 147 6.604 -4.813 13.898 1.00 1.00 C ATOM 1061 CD GLU A 147 7.929 -4.528 13.189 1.00 1.00 C ATOM 1062 OE1 GLU A 147 8.117 -3.430 12.644 1.00 1.00 O ATOM 1063 OE2 GLU A 147 8.782 -5.495 13.217 1.00 1.00 O ATOM 0 H GLU A 147 5.097 -3.017 10.747 1.00 1.00 H new ATOM 0 HA GLU A 147 4.784 -5.496 12.326 1.00 1.00 H new ATOM 0 HB2 GLU A 147 5.972 -2.890 13.153 1.00 1.00 H new ATOM 0 HB3 GLU A 147 4.843 -3.625 14.273 1.00 1.00 H new ATOM 0 HG2 GLU A 147 6.740 -4.734 14.977 1.00 1.00 H new ATOM 0 HG3 GLU A 147 6.289 -5.836 13.691 1.00 1.00 H new ATOM 1069 N PHE A 148 2.493 -4.791 13.100 1.00 1.00 N ATOM 1070 CA PHE A 148 1.075 -4.526 13.270 1.00 1.00 C ATOM 1071 C PHE A 148 0.848 -3.165 13.931 1.00 1.00 C ATOM 1072 O PHE A 148 1.536 -2.812 14.886 1.00 1.00 O ATOM 1073 CB PHE A 148 0.521 -5.622 14.183 1.00 1.00 C ATOM 1074 CG PHE A 148 -0.888 -5.341 14.707 1.00 1.00 C ATOM 1075 CD1 PHE A 148 -1.067 -4.484 15.748 1.00 1.00 C ATOM 1076 CD2 PHE A 148 -1.962 -5.949 14.134 1.00 1.00 C ATOM 1077 CE1 PHE A 148 -2.376 -4.224 16.235 1.00 1.00 C ATOM 1078 CE2 PHE A 148 -3.270 -5.689 14.621 1.00 1.00 C ATOM 1079 CZ PHE A 148 -3.449 -4.832 15.662 1.00 1.00 C ATOM 0 H PHE A 148 2.836 -5.613 13.597 1.00 1.00 H new ATOM 0 HA PHE A 148 0.579 -4.516 12.299 1.00 1.00 H new ATOM 0 HB2 PHE A 148 0.513 -6.566 13.638 1.00 1.00 H new ATOM 0 HB3 PHE A 148 1.194 -5.749 15.031 1.00 1.00 H new ATOM 0 HD1 PHE A 148 -0.215 -4.002 16.204 1.00 1.00 H new ATOM 0 HD2 PHE A 148 -1.819 -6.630 13.308 1.00 1.00 H new ATOM 0 HE1 PHE A 148 -2.519 -3.543 17.061 1.00 1.00 H new ATOM 0 HE2 PHE A 148 -4.122 -6.171 14.165 1.00 1.00 H new ATOM 0 HZ PHE A 148 -4.444 -4.634 16.034 1.00 1.00 H new ATOM 1088 N ASP A 149 -0.122 -2.438 13.396 1.00 1.00 N ATOM 1089 CA ASP A 149 -0.451 -1.124 13.921 1.00 1.00 C ATOM 1090 C ASP A 149 0.483 -0.083 13.299 1.00 1.00 C ATOM 1091 O ASP A 149 0.301 1.117 13.499 1.00 1.00 O ATOM 1092 CB ASP A 149 -0.266 -1.077 15.440 1.00 1.00 C ATOM 1093 CG ASP A 149 -1.104 -0.019 16.160 1.00 1.00 C ATOM 1094 OD1 ASP A 149 -2.319 -0.182 16.345 1.00 1.00 O ATOM 1095 OD2 ASP A 149 -0.450 1.025 16.544 1.00 1.00 O ATOM 0 H ASP A 149 -0.691 -2.735 12.603 1.00 1.00 H new ATOM 0 HA ASP A 149 -1.492 -0.913 13.677 1.00 1.00 H new ATOM 0 HB2 ASP A 149 -0.512 -2.056 15.852 1.00 1.00 H new ATOM 0 HB3 ASP A 149 0.787 -0.895 15.657 1.00 1.00 H new ATOM 1100 N GLU A 150 1.462 -0.582 12.559 1.00 1.00 N ATOM 1101 CA GLU A 150 2.424 0.291 11.906 1.00 1.00 C ATOM 1102 C GLU A 150 1.959 0.629 10.488 1.00 1.00 C ATOM 1103 O GLU A 150 1.292 -0.177 9.842 1.00 1.00 O ATOM 1104 CB GLU A 150 3.816 -0.345 11.889 1.00 1.00 C ATOM 1105 CG GLU A 150 4.193 -0.876 13.274 1.00 1.00 C ATOM 1106 CD GLU A 150 5.652 -0.556 13.606 1.00 1.00 C ATOM 1107 OE1 GLU A 150 6.266 0.294 12.944 1.00 1.00 O ATOM 1108 OE2 GLU A 150 6.146 -1.226 14.592 1.00 1.00 O ATOM 0 H GLU A 150 1.610 -1.578 12.397 1.00 1.00 H new ATOM 0 HA GLU A 150 2.489 1.218 12.476 1.00 1.00 H new ATOM 0 HB2 GLU A 150 3.839 -1.159 11.165 1.00 1.00 H new ATOM 0 HB3 GLU A 150 4.552 0.391 11.565 1.00 1.00 H new ATOM 0 HG2 GLU A 150 3.540 -0.434 14.027 1.00 1.00 H new ATOM 0 HG3 GLU A 150 4.036 -1.954 13.309 1.00 1.00 H new ATOM 1114 N PRO A 151 2.338 1.853 10.035 1.00 1.00 N ATOM 1115 CA PRO A 151 1.967 2.308 8.707 1.00 1.00 C ATOM 1116 C PRO A 151 2.808 1.613 7.634 1.00 1.00 C ATOM 1117 O PRO A 151 3.873 1.072 7.929 1.00 1.00 O ATOM 1118 CB PRO A 151 2.168 3.814 8.736 1.00 1.00 C ATOM 1119 CG PRO A 151 3.082 4.090 9.919 1.00 1.00 C ATOM 1120 CD PRO A 151 3.128 2.835 10.774 1.00 1.00 C ATOM 0 HA PRO A 151 0.936 2.062 8.451 1.00 1.00 H new ATOM 0 HB2 PRO A 151 2.615 4.166 7.806 1.00 1.00 H new ATOM 0 HB3 PRO A 151 1.216 4.333 8.849 1.00 1.00 H new ATOM 0 HG2 PRO A 151 4.082 4.355 9.575 1.00 1.00 H new ATOM 0 HG3 PRO A 151 2.711 4.934 10.500 1.00 1.00 H new ATOM 0 HD2 PRO A 151 4.152 2.491 10.918 1.00 1.00 H new ATOM 0 HD3 PRO A 151 2.710 3.015 11.764 1.00 1.00 H new ATOM 1125 N LEU A 152 2.297 1.649 6.412 1.00 1.00 N ATOM 1126 CA LEU A 152 2.989 1.028 5.295 1.00 1.00 C ATOM 1127 C LEU A 152 3.143 2.049 4.166 1.00 1.00 C ATOM 1128 O LEU A 152 4.226 2.596 3.962 1.00 1.00 O ATOM 1129 CB LEU A 152 2.273 -0.255 4.868 1.00 1.00 C ATOM 1130 CG LEU A 152 2.120 -1.328 5.948 1.00 1.00 C ATOM 1131 CD1 LEU A 152 1.185 -2.445 5.483 1.00 1.00 C ATOM 1132 CD2 LEU A 152 3.483 -1.866 6.386 1.00 1.00 C ATOM 0 H LEU A 152 1.413 2.098 6.171 1.00 1.00 H new ATOM 0 HA LEU A 152 3.993 0.723 5.591 1.00 1.00 H new ATOM 0 HB2 LEU A 152 1.280 0.010 4.504 1.00 1.00 H new ATOM 0 HB3 LEU A 152 2.816 -0.688 4.028 1.00 1.00 H new ATOM 0 HG LEU A 152 1.661 -0.867 6.823 1.00 1.00 H new ATOM 0 HD11 LEU A 152 1.094 -3.194 6.269 1.00 1.00 H new ATOM 0 HD12 LEU A 152 0.202 -2.029 5.263 1.00 1.00 H new ATOM 0 HD13 LEU A 152 1.592 -2.910 4.585 1.00 1.00 H new ATOM 0 HD21 LEU A 152 3.344 -2.627 7.154 1.00 1.00 H new ATOM 0 HD22 LEU A 152 3.994 -2.305 5.529 1.00 1.00 H new ATOM 0 HD23 LEU A 152 4.084 -1.050 6.788 1.00 1.00 H new ATOM 1143 N VAL A 153 2.044 2.276 3.462 1.00 1.00 N ATOM 1144 CA VAL A 153 2.043 3.222 2.359 1.00 1.00 C ATOM 1145 C VAL A 153 0.932 4.251 2.575 1.00 1.00 C ATOM 1146 O VAL A 153 -0.174 3.899 2.982 1.00 1.00 O ATOM 1147 CB VAL A 153 1.917 2.476 1.029 1.00 1.00 C ATOM 1148 CG1 VAL A 153 2.057 3.436 -0.154 1.00 1.00 C ATOM 1149 CG2 VAL A 153 2.938 1.340 0.938 1.00 1.00 C ATOM 0 H VAL A 153 1.148 1.821 3.634 1.00 1.00 H new ATOM 0 HA VAL A 153 2.987 3.766 2.323 1.00 1.00 H new ATOM 0 HB VAL A 153 0.921 2.035 0.986 1.00 1.00 H new ATOM 0 HG11 VAL A 153 1.964 2.880 -1.087 1.00 1.00 H new ATOM 0 HG12 VAL A 153 1.274 4.193 -0.103 1.00 1.00 H new ATOM 0 HG13 VAL A 153 3.033 3.920 -0.116 1.00 1.00 H new ATOM 0 HG21 VAL A 153 2.827 0.826 -0.017 1.00 1.00 H new ATOM 0 HG22 VAL A 153 3.945 1.749 1.015 1.00 1.00 H new ATOM 0 HG23 VAL A 153 2.770 0.634 1.751 1.00 1.00 H new ATOM 1159 N VAL A 154 1.265 5.502 2.295 1.00 1.00 N ATOM 1160 CA VAL A 154 0.308 6.584 2.454 1.00 1.00 C ATOM 1161 C VAL A 154 -0.352 6.877 1.105 1.00 1.00 C ATOM 1162 O VAL A 154 0.333 7.144 0.119 1.00 1.00 O ATOM 1163 CB VAL A 154 0.999 7.808 3.059 1.00 1.00 C ATOM 1164 CG1 VAL A 154 -0.013 8.915 3.360 1.00 1.00 C ATOM 1165 CG2 VAL A 154 1.786 7.428 4.315 1.00 1.00 C ATOM 0 H VAL A 154 2.184 5.791 1.959 1.00 1.00 H new ATOM 0 HA VAL A 154 -0.482 6.297 3.148 1.00 1.00 H new ATOM 0 HB VAL A 154 1.706 8.191 2.324 1.00 1.00 H new ATOM 0 HG11 VAL A 154 0.504 9.773 3.789 1.00 1.00 H new ATOM 0 HG12 VAL A 154 -0.510 9.215 2.437 1.00 1.00 H new ATOM 0 HG13 VAL A 154 -0.755 8.547 4.068 1.00 1.00 H new ATOM 0 HG21 VAL A 154 2.267 8.316 4.725 1.00 1.00 H new ATOM 0 HG22 VAL A 154 1.107 7.008 5.057 1.00 1.00 H new ATOM 0 HG23 VAL A 154 2.545 6.689 4.059 1.00 1.00 H new ATOM 1175 N ILE A 155 -1.676 6.820 1.106 1.00 1.00 N ATOM 1176 CA ILE A 155 -2.437 7.076 -0.105 1.00 1.00 C ATOM 1177 C ILE A 155 -3.152 8.422 0.022 1.00 1.00 C ATOM 1178 O ILE A 155 -3.275 8.963 1.120 1.00 1.00 O ATOM 1179 CB ILE A 155 -3.377 5.906 -0.405 1.00 1.00 C ATOM 1180 CG1 ILE A 155 -2.624 4.757 -1.078 1.00 1.00 C ATOM 1181 CG2 ILE A 155 -4.578 6.366 -1.232 1.00 1.00 C ATOM 1182 CD1 ILE A 155 -2.000 3.825 -0.036 1.00 1.00 C ATOM 0 H ILE A 155 -2.241 6.600 1.926 1.00 1.00 H new ATOM 0 HA ILE A 155 -1.771 7.148 -0.965 1.00 1.00 H new ATOM 0 HB ILE A 155 -3.764 5.527 0.541 1.00 1.00 H new ATOM 0 HG12 ILE A 155 -3.307 4.193 -1.713 1.00 1.00 H new ATOM 0 HG13 ILE A 155 -1.844 5.158 -1.725 1.00 1.00 H new ATOM 0 HG21 ILE A 155 -5.230 5.515 -1.431 1.00 1.00 H new ATOM 0 HG22 ILE A 155 -5.131 7.125 -0.679 1.00 1.00 H new ATOM 0 HG23 ILE A 155 -4.230 6.786 -2.176 1.00 1.00 H new ATOM 0 HD11 ILE A 155 -1.471 3.017 -0.541 1.00 1.00 H new ATOM 0 HD12 ILE A 155 -1.300 4.387 0.582 1.00 1.00 H new ATOM 0 HD13 ILE A 155 -2.785 3.406 0.594 1.00 1.00 H new ATOM 1193 N GLU A 156 -3.608 8.924 -1.116 1.00 1.00 N ATOM 1194 CA GLU A 156 -4.308 10.197 -1.146 1.00 1.00 C ATOM 1195 C GLU A 156 -5.785 9.982 -1.482 1.00 1.00 C ATOM 1196 O GLU A 156 -6.523 10.943 -1.696 1.00 1.00 O ATOM 1197 CB GLU A 156 -3.653 11.160 -2.138 1.00 1.00 C ATOM 1198 CG GLU A 156 -4.156 10.907 -3.561 1.00 1.00 C ATOM 1199 CD GLU A 156 -3.533 11.897 -4.548 1.00 1.00 C ATOM 1200 OE1 GLU A 156 -2.310 12.100 -4.531 1.00 1.00 O ATOM 1201 OE2 GLU A 156 -4.367 12.464 -5.351 1.00 1.00 O ATOM 0 H GLU A 156 -3.506 8.472 -2.025 1.00 1.00 H new ATOM 0 HA GLU A 156 -4.243 10.649 -0.156 1.00 1.00 H new ATOM 0 HB2 GLU A 156 -3.870 12.188 -1.849 1.00 1.00 H new ATOM 0 HB3 GLU A 156 -2.570 11.041 -2.105 1.00 1.00 H new ATOM 0 HG2 GLU A 156 -3.912 9.888 -3.861 1.00 1.00 H new ATOM 0 HG3 GLU A 156 -5.242 10.996 -3.588 1.00 1.00 H new